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

Systemtic Name: 1-[(2-ethyl-4-methoxy-phenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2-ethyl-4-methoxy-phenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2-ethyl-4-methoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2-ethyl-4-methoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(2-ethyl-4-methoxy-benzyl)nipecotic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OC)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)OC)CN2CCCC(C2)C(=O)O

InChI

InChI=1S/C16H23NO3/c1-3-12-9-15(20-2)7-6-13(12)10-17-8-4-5-14(11-17)16(18)19/h6-7,9,14H,3-5,8,10-11H2,1-2H3,(H,18,19)