3-[(4-methylphenyl)carbonylamino]-3-(3-nitrophenyl)propanoic acid

Systemtic Name: 3-[(4-methylphenyl)carbonylamino]-3-(3-nitrophenyl)propanoic acid Openeye Name: 3-[(4-methylbenzoyl)amino]-3-(3-nitrophenyl)propanoic acid CAS Name: 3-[[(4-methylphenyl)-oxomethyl]amino]-3-(3-nitrophenyl)propanoic acid IUPAC Name: 3-[(4-methylbenzoyl)amino]-3-(3-nitrophenyl)propanoic acid Traditional Name: 3-(3-nitrophenyl)-3-(p-toluoylamino)propionic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5/c1-11-5-7-12(8-6-11)17(22)18-15(10-16(20)21)13-3-2-4-14(9-13)19(23)24/h2-9,15H,10H2,1H3,(H,18,22)(H,20,21)