1-[3-(3-methylphenoxy)propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(3-methylphenoxy)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(3-methylphenoxy)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(3-methylphenoxy)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(3-methylphenoxy)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(3-methylphenoxy)propanoyl]isonipecotic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-12-3-2-4-14(11-12)21-10-7-15(18)17-8-5-13(6-9-17)16(19)20/h2-4,11,13H,5-10H2,1H3,(H,19,20)