4-[(3-bromanyl-4-methyl-phenyl)amino]-4-oxidanylidene-2-(1-phenylethyl)butanoic acid

Systemtic Name: 4-[(3-bromanyl-4-methyl-phenyl)amino]-4-oxidanylidene-2-(1-phenylethyl)butanoic acid Openeye Name: 4-(3-bromo-4-methyl-anilino)-4-oxo-2-(1-phenylethyl)butanoic acid CAS Name: 4-(3-bromo-4-methylanilino)-4-oxo-2-(1-phenylethyl)butanoic acid IUPAC Name: 4-(3-bromo-4-methylanilino)-4-oxo-2-(1-phenylethyl)butanoic acid Traditional Name: 4-(3-bromo-4-methyl-anilino)-4-keto-2-(1-phenylethyl)butyric acid Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrNO3/c1-12-8-9-15(10-17(12)20)21-18(22)11-16(19(23)24)13(2)14-6-4-3-5-7-14/h3-10,13,16H,11H2,1-2H3,(H,21,22)(H,23,24)