3-[(3-bromophenyl)carbonylamino]-3-(4-methoxyphenyl)propanoic acid

Systemtic Name: 3-[(3-bromophenyl)carbonylamino]-3-(4-methoxyphenyl)propanoic acid Openeye Name: 3-[(3-bromobenzoyl)amino]-3-(4-methoxyphenyl)propanoic acid CAS Name: 3-[[(3-bromophenyl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-[(3-bromobenzoyl)amino]-3-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[(3-bromobenzoyl)amino]-3-(4-methoxyphenyl)propionic acid Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H16BrNO4/c1-23-14-7-5-11(6-8-14)15(10-16(20)21)19-17(22)12-3-2-4-13(18)9-12/h2-9,15H,10H2,1H3,(H,19,22)(H,20,21)