methyl 3-[[[4-[(2-chlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamoyl]benzoate

Systemtic Name: methyl 3-[[[4-[(2-chlorophenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamoyl]benzoate Openeye Name: methyl 3-[[[4-(2-chloroanilino)-4-oxo-butanoyl]amino]carbamoyl]benzoate CAS Name: 3-[[[4-(2-chloroanilino)-1,4-dioxobutyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[[4-(2-chloroanilino)-4-oxobutanoyl]amino]carbamoyl]benzoate Traditional Name: 3-[[[4-(2-chloroanilino)-4-keto-butanoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C19H18ClN3O5 MolecularWeight: 403.81632

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NNC(=O)CCC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C19H18ClN3O5/c1-28-19(27)13-6-4-5-12(11-13)18(26)23-22-17(25)10-9-16(24)21-15-8-3-2-7-14(15)20/h2-8,11H,9-10H2,1H3,(H,21,24)(H,22,25)(H,23,26)