1-[(1-methylpyrrol-2-yl)-pyridin-3-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-methylpyrrol-2-yl)-pyridin-3-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-methylpyrrol-2-yl)-(3-pyridyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-methyl-2-pyrrolyl)-(3-pyridinyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-methylpyrrol-2-yl)-pyridin-3-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-methylpyrrol-2-yl)-(3-pyridyl)methyl]isonipecotic acid Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(C2=CN=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CN1C=CC=C1C(C2=CN=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C17H21N3O2/c1-19-9-3-5-15(19)16(14-4-2-8-18-12-14)20-10-6-13(7-11-20)17(21)22/h2-5,8-9,12-13,16H,6-7,10-11H2,1H3,(H,21,22)