1-[(4-ethoxy-2-ethyl-phenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-ethoxy-2-ethyl-phenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-ethoxy-2-ethyl-phenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-ethoxy-2-ethylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethoxy-2-ethylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(4-ethoxy-2-ethyl-benzyl)isonipecotic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCC)CN2CCC(CC2)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)OCC)CN2CCC(CC2)C(=O)O

InChI

InChI=1S/C17H25NO3/c1-3-13-11-16(21-4-2)6-5-15(13)12-18-9-7-14(8-10-18)17(19)20/h5-6,11,14H,3-4,7-10,12H2,1-2H3,(H,19,20)