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

Systemtic Name: methyl 3-[[[4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoyl]amino]carbamoyl]benzoate Openeye Name: methyl 3-[[[4-(4-ethoxyanilino)-4-oxo-butanoyl]amino]carbamoyl]benzoate CAS Name: 3-[[[4-(4-ethoxyanilino)-1,4-dioxobutyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[[4-(4-ethoxyanilino)-4-oxobutanoyl]amino]carbamoyl]benzoate Traditional Name: 3-[[[4-keto-4-(p-phenetidino)butanoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C21H23N3O6/c1-3-30-17-9-7-16(8-10-17)22-18(25)11-12-19(26)23-24-20(27)14-5-4-6-15(13-14)21(28)29-2/h4-10,13H,3,11-12H2,1-2H3,(H,22,25)(H,23,26)(H,24,27)