2-(4-butylpiperidin-1-yl)carbonylbenzoic acid

Systemtic Name: 2-(4-butylpiperidin-1-yl)carbonylbenzoic acid Openeye Name: 2-(4-butylpiperidine-1-carbonyl)benzoic acid CAS Name: 2-[(4-butyl-1-piperidinyl)-oxomethyl]benzoic acid IUPAC Name: 2-(4-butylpiperidine-1-carbonyl)benzoic acid Traditional Name: 2-(4-butylpiperidine-1-carbonyl)benzoic acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCC1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H23NO3/c1-2-3-6-13-9-11-18(12-10-13)16(19)14-7-4-5-8-15(14)17(20)21/h4-5,7-8,13H,2-3,6,9-12H2,1H3,(H,20,21)