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

Systemtic Name: [2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-[(2-methylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl] 4-(2-methylanilino)-4-oxo-butanoate CAS Name: 4-(2-methylanilino)-4-oxobutanoic acid [2-(3-chloro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methylanilino)-2-oxoethyl] 4-(2-methylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(o-toluidino)butyric acid [2-(3-chloro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCC(=O)NC2=CC=CC=C2C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCC(=O)NC2=CC=CC=C2C)Cl

InChI

InChI=1S/C20H21ClN2O4/c1-13-7-8-15(11-16(13)21)22-19(25)12-27-20(26)10-9-18(24)23-17-6-4-3-5-14(17)2/h3-8,11H,9-10,12H2,1-2H3,(H,22,25)(H,23,24)