carbanide; 2-[[oxidanyl(phenylmethoxycarbonylaminomethyl)phosphoryl]amino]-3-phenyl-propanoate; zinc

Systemtic Name: carbanide; 2-[[oxidanyl(phenylmethoxycarbonylaminomethyl)phosphoryl]amino]-3-phenyl-propanoate; zinc Openeye Name: 2-[[benzyloxycarbonylaminomethyl(hydroxy)phosphoryl]amino]-3-phenyl-propanoate; carbanide; zinc CAS Name: carbanide; 2-[[hydroxy(phenylmethoxycarbonylaminomethyl)phosphoryl]amino]-3-phenylpropanoate; zinc IUPAC Name: carbanide; 2-[[hydroxy(phenylmethoxycarbonylaminomethyl)phosphoryl]amino]-3-phenylpropanoate; zinc Traditional Name: 2-[[benzyloxycarbonylaminomethyl(hydroxy)phosphoryl]amino]-3-phenyl-propionate; carbanide; zinc Formula: C21H29N2O6PZn-4 MolecularWeight: 501.847521

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].[CH3-].C1=CC=C(C=C1)CC(C(=O)[O-])NP(=O)(CNC(=O)OCC2=CC=CC=C2)O.[Zn]

Isomeric SMILES

[CH3-].[CH3-].[CH3-].C1=CC=C(C=C1)CC(C(=O)[O-])NP(=O)(CNC(=O)OCC2=CC=CC=C2)O.[Zn]

InChI

InChI=1S/C18H21N2O6P.3CH3.Zn/c21-17(22)16(11-14-7-3-1-4-8-14)20-27(24,25)13-19-18(23)26-12-15-9-5-2-6-10-15;;;;/h1-10,16H,11-13H2,(H,19,23)(H,21,22)(H2,20,24,25);3*1H3;/q;3*-1;/p-1