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

Systemtic Name: 3-(4-iodophenyl)-2-[(3-methylphenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-iodophenyl)-2-[(3-methylbenzoyl)amino]propanoic acid CAS Name: 3-(4-iodophenyl)-2-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-iodophenyl)-2-[(3-methylbenzoyl)amino]propanoic acid Traditional Name: 3-(4-iodophenyl)-2-(m-toluoylamino)propionic acid Formula: C17H16INO3 MolecularWeight: 409.21831

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16INO3/c1-11-3-2-4-13(9-11)16(20)19-15(17(21)22)10-12-5-7-14(18)8-6-12/h2-9,15H,10H2,1H3,(H,19,20)(H,21,22)