5-[6-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]pyridin-3-yl]-4-phenyl-pentanoic acid

Systemtic Name: 5-[6-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]pyridin-3-yl]-4-phenyl-pentanoic acid Openeye Name: 5-[6-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]-3-pyridyl]-4-phenyl-pentanoic acid CAS Name: 5-[6-[2-[methyl(phenethyl)amino]-2-oxoethyl]-3-pyridinyl]-4-phenylpentanoic acid IUPAC Name: 5-[6-[2-[methyl(phenethyl)amino]-2-oxoethyl]pyridin-3-yl]-4-phenylpentanoic acid Traditional Name: 5-[6-[2-keto-2-[methyl(phenethyl)amino]ethyl]-3-pyridyl]-4-phenyl-valeric acid Formula: C27H30N2O3 MolecularWeight: 430.5387

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2=NC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CC2=NC=C(C=C2)CC(CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C27H30N2O3/c1-29(17-16-21-8-4-2-5-9-21)26(30)19-25-14-12-22(20-28-25)18-24(13-15-27(31)32)23-10-6-3-7-11-23/h2-12,14,20,24H,13,15-19H2,1H3,(H,31,32)