3-[[1-[(4-fluorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-(4-methylphenyl)propanoic acid

Systemtic Name: 3-[[1-[(4-fluorophenyl)methyl]-2-oxidanylidene-pyridin-3-yl]carbamoylamino]-3-(4-methylphenyl)propanoic acid Openeye Name: 3-[[1-[(4-fluorophenyl)methyl]-2-oxo-3-pyridyl]carbamoylamino]-3-(p-tolyl)propanoic acid CAS Name: 3-[[[[1-[(4-fluorophenyl)methyl]-2-oxo-3-pyridinyl]amino]-oxomethyl]amino]-3-(4-methylphenyl)propanoic acid IUPAC Name: 3-[[1-[(4-fluorophenyl)methyl]-2-oxopyridin-3-yl]carbamoylamino]-3-(4-methylphenyl)propanoic acid Traditional Name: 3-[[1-(4-fluorobenzyl)-2-keto-3-pyridyl]carbamoylamino]-3-(p-tolyl)propionic acid Formula: C23H22FN3O4 MolecularWeight: 423.436883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)NC2=CC=CN(C2=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)O)NC(=O)NC2=CC=CN(C2=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C23H22FN3O4/c1-15-4-8-17(9-5-15)20(13-21(28)29)26-23(31)25-19-3-2-12-27(22(19)30)14-16-6-10-18(24)11-7-16/h2-12,20H,13-14H2,1H3,(H,28,29)(H2,25,26,31)