[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-5-phenylazanyl-pentanoate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-oxidanylidene-5-phenylazanyl-pentanoate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] 5-anilino-5-oxo-pentanoate CAS Name: 5-anilino-5-oxopentanoic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] 5-anilino-5-oxopentanoate Traditional Name: 5-anilino-5-keto-valeric acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)CCCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)CCCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4/c1-15-8-6-9-16(2)21(15)23-19(25)14-27-20(26)13-7-12-18(24)22-17-10-4-3-5-11-17/h3-6,8-11H,7,12-14H2,1-2H3,(H,22,24)(H,23,25)