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

Systemtic Name: 1-[(4-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)-(1-methyl-2-pyrrolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-methoxyphenyl)-(1-methylpyrrol-2-yl)methyl]isonipecotic acid Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3/c1-20-11-3-4-17(20)18(14-5-7-16(24-2)8-6-14)21-12-9-15(10-13-21)19(22)23/h3-8,11,15,18H,9-10,12-13H2,1-2H3,(H,22,23)