1-(3,4-diethoxyphenyl)carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-(3,4-diethoxyphenyl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(3,4-diethoxybenzoyl)piperidine-3-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(3,4-diethoxybenzoyl)piperidine-3-carboxylic acid Traditional Name: 1-(3,4-diethoxybenzoyl)nipecotic acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCCC(C2)C(=O)O)OCC

InChI

InChI=1S/C17H23NO5/c1-3-22-14-8-7-12(10-15(14)23-4-2)16(19)18-9-5-6-13(11-18)17(20)21/h7-8,10,13H,3-6,9,11H2,1-2H3,(H,20,21)