1-[ethyl-(2-methylphenyl)carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[ethyl-(2-methylphenyl)carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[ethyl(o-tolyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[(N-ethyl-2-methylanilino)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[ethyl-(2-methylphenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[ethyl(o-tolyl)carbamoyl]nipecotic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1C)C(=O)N2CCCC(C2)C(=O)O

Isomeric SMILES

CCN(C1=CC=CC=C1C)C(=O)N2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H22N2O3/c1-3-18(14-9-5-4-7-12(14)2)16(21)17-10-6-8-13(11-17)15(19)20/h4-5,7,9,13H,3,6,8,10-11H2,1-2H3,(H,19,20)