1-[[3-(3-methylbutoxy)phenyl]methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[[3-(3-methylbutoxy)phenyl]methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-isopentyloxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[[3-(3-methylbutoxy)phenyl]methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[[3-(3-methylbutoxy)phenyl]methyl]piperidine-2-carboxylic acid Traditional Name: 1-(3-isoamoxybenzyl)pipecolinic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)CN2CCCCC2C(=O)O

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)CN2CCCCC2C(=O)O

InChI

InChI=1S/C18H27NO3/c1-14(2)9-11-22-16-7-5-6-15(12-16)13-19-10-4-3-8-17(19)18(20)21/h5-7,12,14,17H,3-4,8-11,13H2,1-2H3,(H,20,21)