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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)CN2CCCC(C2)C(=O)O)OC

InChI

InChI=1S/C18H27NO4/c1-13(2)12-23-16-7-6-14(9-17(16)22-3)10-19-8-4-5-15(11-19)18(20)21/h6-7,9,13,15H,4-5,8,10-12H2,1-3H3,(H,20,21)