6-[3-(3-methoxyphenyl)-1-(phenylmethyl)piperidin-3-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[3-(3-methoxyphenyl)-1-(phenylmethyl)piperidin-3-yl]pyridine-3-carboxylic acid Openeye Name: 6-[1-benzyl-3-(3-methoxyphenyl)-3-piperidyl]pyridine-3-carboxylic acid CAS Name: 6-[3-(3-methoxyphenyl)-1-(phenylmethyl)-3-piperidinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[1-benzyl-3-(3-methoxyphenyl)piperidin-3-yl]pyridine-3-carboxylic acid Traditional Name: 6-[1-benzyl-3-(3-methoxyphenyl)-3-piperidyl]nicotinic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC=CC=C3)C4=NC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCCN(C2)CC3=CC=CC=C3)C4=NC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H26N2O3/c1-30-22-10-5-9-21(15-22)25(23-12-11-20(16-26-23)24(28)29)13-6-14-27(18-25)17-19-7-3-2-4-8-19/h2-5,7-12,15-16H,6,13-14,17-18H2,1H3,(H,28,29)