O1-ethyl O4-methyl (E)-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]but-2-enedioate

Systemtic Name: O1-ethyl O4-methyl (E)-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]but-2-enedioate Openeye Name: O1-ethyl O4-methyl (E)-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]but-2-enedioate CAS Name: (E)-2-[(1E)-1-[[anilino(oxo)methyl]hydrazinylidene]ethyl]-2-butenedioic acid O1-ethyl ester O4-methyl ester IUPAC Name: 1-O-ethyl 4-O-methyl (E)-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]but-2-enedioate Traditional Name: (E)-2-[(E)-C-methyl-N-(phenylcarbamoylamino)carbonimidoyl]but-2-enedioic acid O1-ethyl ester O4-methyl ester Formula: C16H19N3O5 MolecularWeight: 333.33916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O5/c1-4-24-15(21)13(10-14(20)23-3)11(2)18-19-16(22)17-12-8-6-5-7-9-12/h5-10H,4H2,1-3H3,(H2,17,19,22)/b13-10+,18-11+