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

Systemtic Name: 1-[(4-ethoxy-2-propan-2-yl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethoxy-2-isopropyl-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethoxy-2-propan-2-ylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethoxy-2-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-ethoxy-2-isopropyl-benzyl)isonipecotic acid Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)CN2CCC(CC2)C(=O)O)C(C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1)CN2CCC(CC2)C(=O)O)C(C)C

InChI

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