diethyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate

Systemtic Name: diethyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate Openeye Name: diethyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate CAS Name: 2-[(1E)-1-[[anilino(oxo)methyl]hydrazinylidene]ethyl]-3-diethoxyphosphorylbutanedioic acid diethyl ester IUPAC Name: diethyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate Traditional Name: 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]succinic acid diethyl ester Formula: C21H32N3O8P MolecularWeight: 485.467841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)OCC)P(=O)(OCC)OCC)C(=NNC(=O)NC1=CC=CC=C1)C

Isomeric SMILES

CCOC(=O)C(C(C(=O)OCC)P(=O)(OCC)OCC)/C(=N/NC(=O)NC1=CC=CC=C1)/C

InChI

InChI=1S/C21H32N3O8P/c1-6-29-19(25)17(15(5)23-24-21(27)22-16-13-11-10-12-14-16)18(20(26)30-7-2)33(28,31-8-3)32-9-4/h10-14,17-18H,6-9H2,1-5H3,(H2,22,24,27)/b23-15+