[2-[(4-bromanyl-2,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-bromanyl-2,5-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromo-2,5-dimethyl-anilino)-2-oxo-ethyl] 4-(1-naphthylamino)-4-oxo-butanoate CAS Name: 4-(1-naphthalenylamino)-4-oxobutanoic acid [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2,5-dimethylanilino)-2-oxoethyl] 4-(naphthalen-1-ylamino)-4-oxobutanoate Traditional Name: 4-keto-4-(1-naphthylamino)butyric acid [2-(4-bromo-2,5-dimethyl-anilino)-2-keto-ethyl] ester Formula: C24H23BrN2O4 MolecularWeight: 483.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)NC(=O)COC(=O)CCC(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)NC(=O)COC(=O)CCC(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C24H23BrN2O4/c1-15-13-21(16(2)12-19(15)25)27-23(29)14-31-24(30)11-10-22(28)26-20-9-5-7-17-6-3-4-8-18(17)20/h3-9,12-13H,10-11,14H2,1-2H3,(H,26,28)(H,27,29)