methyl 4-[[3-chloranyl-4-[(4-methyl-3-oxidanyl-phenyl)amino]-2,5-bis(oxidanylidene)pyrrol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-chloranyl-4-[(4-methyl-3-oxidanyl-phenyl)amino]-2,5-bis(oxidanylidene)pyrrol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-chloro-4-(3-hydroxy-4-methyl-anilino)-2,5-dioxo-pyrrol-1-yl]methyl]benzoate CAS Name: 4-[[3-chloro-4-(3-hydroxy-4-methylanilino)-2,5-dioxo-1-pyrrolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-chloro-4-(3-hydroxy-4-methylanilino)-2,5-dioxopyrrol-1-yl]methyl]benzoate Traditional Name: 4-[[3-chloro-4-(3-hydroxy-4-methyl-anilino)-2,5-diketo-3-pyrrolin-1-yl]methyl]benzoic acid methyl ester Formula: C20H17ClN2O5 MolecularWeight: 400.81238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=C(C=C3)C(=O)OC)Cl)O

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C(=O)N(C2=O)CC3=CC=C(C=C3)C(=O)OC)Cl)O

InChI

InChI=1S/C20H17ClN2O5/c1-11-3-8-14(9-15(11)24)22-17-16(21)18(25)23(19(17)26)10-12-4-6-13(7-5-12)20(27)28-2/h3-9,22,24H,10H2,1-2H3