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

Systemtic Name: 1-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-isobutoxy-3-methoxy-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-isobutoxy-3-methoxy-benzyl)isonipecotic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CN2CCC(CC2)C(=O)O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)CN2CCC(CC2)C(=O)O)OC

InChI

InChI=1S/C18H27NO4/c1-13(2)12-23-16-5-4-14(10-17(16)22-3)11-19-8-6-15(7-9-19)18(20)21/h4-5,10,13,15H,6-9,11-12H2,1-3H3,(H,20,21)