methyl 3-(4-chlorophenyl)carbonyl-5-morpholin-4-yl-4,5-bis(oxidanylidene)-2-phenylazanyl-pent-2-enoate

Systemtic Name: methyl 3-(4-chlorophenyl)carbonyl-5-morpholin-4-yl-4,5-bis(oxidanylidene)-2-phenylazanyl-pent-2-enoate Openeye Name: methyl 2-anilino-3-(4-chlorobenzoyl)-5-morpholino-4,5-dioxo-pent-2-enoate CAS Name: 2-anilino-3-[(4-chlorophenyl)-oxomethyl]-5-(4-morpholinyl)-4,5-dioxo-2-pentenoic acid methyl ester IUPAC Name: methyl 2-anilino-3-(4-chlorobenzoyl)-5-morpholin-4-yl-4,5-dioxopent-2-enoate Traditional Name: 2-anilino-3-(4-chlorobenzoyl)-4,5-diketo-5-morpholino-pent-2-enoic acid methyl ester Formula: C23H21ClN2O6 MolecularWeight: 456.87564

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(C(=O)C1=CC=C(C=C1)Cl)C(=O)C(=O)N2CCOCC2)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(=C(C(=O)C1=CC=C(C=C1)Cl)C(=O)C(=O)N2CCOCC2)NC3=CC=CC=C3

InChI

InChI=1S/C23H21ClN2O6/c1-31-23(30)19(25-17-5-3-2-4-6-17)18(20(27)15-7-9-16(24)10-8-15)21(28)22(29)26-11-13-32-14-12-26/h2-10,25H,11-14H2,1H3