1-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)carbamoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)carbamoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)carbamoyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[[(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)amino]-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethyl-2-methoxy-6-methylpyridin-3-yl)carbamoyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)carbamoyl]-4-phenyl-isonipecotic acid Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)OC)NC(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1=CC(=C(N=C1C)OC)NC(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H27N3O4/c1-4-16-14-18(19(29-3)23-15(16)2)24-21(28)25-12-10-22(11-13-25,20(26)27)17-8-6-5-7-9-17/h5-9,14H,4,10-13H2,1-3H3,(H,24,28)(H,26,27)