3-[(4-bromophenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoic acid

Systemtic Name: 3-[(4-bromophenyl)methyl]-4-oxidanylidene-4-phenylazanyl-butanoic acid Openeye Name: 4-anilino-3-[(4-bromophenyl)methyl]-4-oxo-butanoic acid CAS Name: 4-anilino-3-[(4-bromophenyl)methyl]-4-oxobutanoic acid IUPAC Name: 4-anilino-3-[(4-bromophenyl)methyl]-4-oxobutanoic acid Traditional Name: 4-anilino-3-(4-bromobenzyl)-4-keto-butyric acid Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO3/c18-14-8-6-12(7-9-14)10-13(11-16(20)21)17(22)19-15-4-2-1-3-5-15/h1-9,13H,10-11H2,(H,19,22)(H,20,21)