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

Systemtic Name: 2-[(3-bromophenyl)carbonylamino]-3-(4-iodophenyl)propanoic acid Openeye Name: 2-[(3-bromobenzoyl)amino]-3-(4-iodophenyl)propanoic acid CAS Name: 2-[[(3-bromophenyl)-oxomethyl]amino]-3-(4-iodophenyl)propanoic acid IUPAC Name: 2-[(3-bromobenzoyl)amino]-3-(4-iodophenyl)propanoic acid Traditional Name: 2-[(3-bromobenzoyl)amino]-3-(4-iodophenyl)propionic acid Formula: C16H13BrINO3 MolecularWeight: 474.08779

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrINO3/c17-12-3-1-2-11(9-12)15(20)19-14(16(21)22)8-10-4-6-13(18)7-5-10/h1-7,9,14H,8H2,(H,19,20)(H,21,22)