O1-ethyl O4-methyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate

Systemtic Name: O1-ethyl O4-methyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate Openeye Name: O1-ethyl O4-methyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate CAS Name: 3-[(1E)-1-[[anilino(oxo)methyl]hydrazinylidene]ethyl]-2-diethoxyphosphorylbutanedioic acid O1-ethyl ester O4-methyl ester IUPAC Name: 1-O-ethyl 4-O-methyl 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]butanedioate Traditional Name: 2-diethoxyphosphoryl-3-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]succinic acid O1-ethyl ester O4-methyl ester Formula: C20H30N3O8P MolecularWeight: 471.441261

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N3O8P/c1-6-29-19(25)17(32(27,30-7-2)31-8-3)16(18(24)28-5)14(4)22-23-20(26)21-15-12-10-9-11-13-15/h9-13,16-17H,6-8H2,1-5H3,(H2,21,23,26)/b22-14+