[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] 4-[(3-chloranyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl] 4-[(3-chloranyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-ethylanilino)-2-oxo-ethyl] 4-(3-chloro-4-methyl-anilino)-4-oxo-butanoate CAS Name: 4-(3-chloro-4-methylanilino)-4-oxobutanoic acid [2-(4-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylanilino)-2-oxoethyl] 4-(3-chloro-4-methylanilino)-4-oxobutanoate Traditional Name: 4-(3-chloro-4-methyl-anilino)-4-keto-butyric acid [2-(4-ethylanilino)-2-keto-ethyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-3-15-5-8-16(9-6-15)23-20(26)13-28-21(27)11-10-19(25)24-17-7-4-14(2)18(22)12-17/h4-9,12H,3,10-11,13H2,1-2H3,(H,23,26)(H,24,25)