1-[(5-tert-butyl-4-methoxy-2-methyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-tert-butyl-4-methoxy-2-methyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-tert-butyl-4-methoxy-2-methyl-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-tert-butyl-4-methoxy-2-methylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(5-tert-butyl-4-methoxy-2-methyl-benzyl)isonipecotic acid Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCC(CC2)C(=O)O)C(C)(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCC(CC2)C(=O)O)C(C)(C)C)OC

InChI

InChI=1S/C19H29NO3/c1-13-10-17(23-5)16(19(2,3)4)11-15(13)12-20-8-6-14(7-9-20)18(21)22/h10-11,14H,6-9,12H2,1-5H3,(H,21,22)