WVU

(phenylmethyl) 3-oxidanylidenepiperazine-1-carboxylate

Created:	2023-10-16
Last modified:	2024-03-27

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1 entries where WVU is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	6

2D diagram of WVU

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Chemical Component Summary
Name	(phenylmethyl) 3-oxidanylidenepiperazine-1-carboxylate
Systematic Name (OpenEye OEToolkits)	(phenylmethyl) 3-oxidanylidenepiperazine-1-carboxylate
Formula	C₁₂ H₁₄ N₂ O₃
Molecular Weight	234.251
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=C1CN(CCN1)C(=O)OCc2ccccc2
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)COC(=O)N2CCNC(=O)C2
Canonical SMILES	CACTVS	3.385	O=C1CN(CCN1)C(=O)OCc2ccccc2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)COC(=O)N2CCNC(=O)C2
InChI	InChI	1.06	InChI=1S/C12H14N2O3/c15-11-8-14(7-6-13-11)12(16)17-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,15)
InChIKey	InChI	1.06	BAHFPJFBMJTOPU-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	736777

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