1-[(4-tert-butylphenyl)methyl]-4-phenethyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-4-phenethyl-piperidine-4-carboxylic acid Openeye Name: 1-[(4-tert-butylphenyl)methyl]-4-phenethyl-piperidine-4-carboxylic acid CAS Name: 1-[(4-tert-butylphenyl)methyl]-4-phenethyl-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-4-phenethylpiperidine-4-carboxylic acid Traditional Name: 1-(4-tert-butylbenzyl)-4-phenethyl-isonipecotic acid Formula: C25H33NO2 MolecularWeight: 379.53502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CCC(CC2)(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CCC(CC2)(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H33NO2/c1-24(2,3)22-11-9-21(10-12-22)19-26-17-15-25(16-18-26,23(27)28)14-13-20-7-5-4-6-8-20/h4-12H,13-19H2,1-3H3,(H,27,28)