3-(3-bromophenyl)-2-[(4-methylphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(3-bromophenyl)-2-[(4-methylphenyl)carbonylamino]propanoic acid Openeye Name: 3-(3-bromophenyl)-2-[(4-methylbenzoyl)amino]propanoic acid CAS Name: 3-(3-bromophenyl)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3-bromophenyl)-2-[(4-methylbenzoyl)amino]propanoic acid Traditional Name: 3-(3-bromophenyl)-2-(p-toluoylamino)propionic acid Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO3/c1-11-5-7-13(8-6-11)16(20)19-15(17(21)22)10-12-3-2-4-14(18)9-12/h2-9,15H,10H2,1H3,(H,19,20)(H,21,22)