[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 5-[(3-chloranyl-4-methyl-phenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 5-[(3-chloranyl-4-methyl-phenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] 5-(3-chloro-4-methyl-anilino)-5-oxo-pentanoate CAS Name: 5-(3-chloro-4-methylanilino)-5-oxopentanoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] 5-(3-chloro-4-methylanilino)-5-oxopentanoate Traditional Name: 5-(3-chloro-4-methyl-anilino)-5-keto-valeric acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)OCC(=O)NC2=CC=CC=C2C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCC(=O)OCC(=O)NC2=CC=CC=C2C)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-14-10-11-16(12-17(14)22)23-19(25)8-5-9-21(27)28-13-20(26)24-18-7-4-3-6-15(18)2/h3-4,6-7,10-12H,5,8-9,13H2,1-2H3,(H,23,25)(H,24,26)