4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-oxidanylidenepyridin-1-yl)methyl]phenyl]butanoic acid

Systemtic Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-oxidanylidenepyridin-1-yl)methyl]phenyl]butanoic acid Openeye Name: 4-[2-[2-(1-naphthyl)propanoylamino]-4-[(2-oxo-1-pyridyl)methyl]phenyl]butanoic acid CAS Name: 4-[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-4-[(2-oxo-1-pyridinyl)methyl]phenyl]butanoic acid IUPAC Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-[(2-oxopyridin-1-yl)methyl]phenyl]butanoic acid Traditional Name: 4-[4-[(2-keto-1-pyridyl)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butyric acid Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)CN4C=CC=CC4=O)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)CN4C=CC=CC4=O)CCCC(=O)O

InChI

InChI=1S/C29H28N2O4/c1-20(24-12-6-9-22-8-2-3-11-25(22)24)29(35)30-26-18-21(19-31-17-5-4-13-27(31)32)15-16-23(26)10-7-14-28(33)34/h2-6,8-9,11-13,15-18,20H,7,10,14,19H2,1H3,(H,30,35)(H,33,34)