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

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-bromo-3-chloro-2-methyl-anilino)-2-oxo-ethyl] 4-(4-ethoxyanilino)-4-oxo-butanoate CAS Name: 4-(4-ethoxyanilino)-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-(4-ethoxyanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(p-phenetidino)butyric acid [2-(4-bromo-3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C21H22BrClN2O5 MolecularWeight: 497.76678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)NC2=C(C(=C(C=C2)Br)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)NC2=C(C(=C(C=C2)Br)Cl)C

InChI

InChI=1S/C21H22BrClN2O5/c1-3-29-15-6-4-14(5-7-15)24-18(26)10-11-20(28)30-12-19(27)25-17-9-8-16(22)21(23)13(17)2/h4-9H,3,10-12H2,1-2H3,(H,24,26)(H,25,27)