1-[(4-methoxy-3-propan-2-yl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-methoxy-3-propan-2-yl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3-isopropyl-4-methoxy-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methoxy-3-propan-2-ylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methoxy-3-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(3-isopropyl-4-methoxy-benzyl)isonipecotic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)CN2CCC(CC2)C(=O)O)OC

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)CN2CCC(CC2)C(=O)O)OC

InChI

InChI=1S/C17H25NO3/c1-12(2)15-10-13(4-5-16(15)21-3)11-18-8-6-14(7-9-18)17(19)20/h4-5,10,12,14H,6-9,11H2,1-3H3,(H,19,20)