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

Systemtic Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-isopentyloxy-3-methoxy-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-isoamoxy-3-methoxy-benzyl)isonipecotic acid Formula: C19H29NO4 MolecularWeight: 335.43786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO4/c1-14(2)8-11-24-17-5-4-15(12-18(17)23-3)13-20-9-6-16(7-10-20)19(21)22/h4-5,12,14,16H,6-11,13H2,1-3H3,(H,21,22)