2-[[3-(2-naphthalen-1-ylpropanoylamino)pyridin-4-yl]methyl]benzoic acid

Systemtic Name: 2-[[3-(2-naphthalen-1-ylpropanoylamino)pyridin-4-yl]methyl]benzoic acid Openeye Name: 2-[[3-[2-(1-naphthyl)propanoylamino]-4-pyridyl]methyl]benzoic acid CAS Name: 2-[[3-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-4-pyridinyl]methyl]benzoic acid IUPAC Name: 2-[[3-(2-naphthalen-1-ylpropanoylamino)pyridin-4-yl]methyl]benzoic acid Traditional Name: 2-[[3-[2-(1-naphthyl)propanoylamino]-4-pyridyl]methyl]benzoic acid Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CN=C3)CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CN=C3)CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C26H22N2O3/c1-17(21-12-6-9-18-7-2-4-10-22(18)21)25(29)28-24-16-27-14-13-20(24)15-19-8-3-5-11-23(19)26(30)31/h2-14,16-17H,15H2,1H3,(H,28,29)(H,30,31)