2-[(4-bromophenyl)methyl]-4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[(4-bromophenyl)methyl]-4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-[(4-bromophenyl)methyl]-4-(4-methylanilino)-4-oxo-butanoic acid CAS Name: 2-[(4-bromophenyl)methyl]-4-(4-methylanilino)-4-oxobutanoic acid IUPAC Name: 2-[(4-bromophenyl)methyl]-4-(4-methylanilino)-4-oxobutanoic acid Traditional Name: 2-(4-bromobenzyl)-4-keto-4-(p-toluidino)butyric acid Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC(CC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC(CC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C18H18BrNO3/c1-12-2-8-16(9-3-12)20-17(21)11-14(18(22)23)10-13-4-6-15(19)7-5-13/h2-9,14H,10-11H2,1H3,(H,20,21)(H,22,23)