[2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromo-3-chloro-2-methyl-anilino)-2-oxo-ethyl] 4-(1-naphthylamino)-4-oxo-butanoate CAS Name: 4-(1-naphthalenylamino)-4-oxobutanoic acid [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloro-2-methylanilino)-2-oxoethyl] 4-(naphthalen-1-ylamino)-4-oxobutanoate Traditional Name: 4-keto-4-(1-naphthylamino)butyric acid [2-(4-bromo-3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C23H20BrClN2O4 MolecularWeight: 503.7729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)Br)NC(=O)COC(=O)CCC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1Cl)Br)NC(=O)COC(=O)CCC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H20BrClN2O4/c1-14-18(10-9-17(24)23(14)25)26-21(29)13-31-22(30)12-11-20(28)27-19-8-4-6-15-5-2-3-7-16(15)19/h2-10H,11-13H2,1H3,(H,26,29)(H,27,28)