1-[[6-(3-phenylpropoxy)naphthalen-2-yl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[6-(3-phenylpropoxy)naphthalen-2-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[6-(3-phenylpropoxy)-2-naphthyl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[6-(3-phenylpropoxy)-2-naphthalenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[6-(3-phenylpropoxy)naphthalen-2-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[6-(3-phenylpropoxy)-2-naphthyl]methyl]isonipecotic acid Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=CC3=C(C=C2)C=C(C=C3)OCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=CC3=C(C=C2)C=C(C=C3)OCCCC4=CC=CC=C4

InChI

InChI=1S/C26H29NO3/c28-26(29)22-12-14-27(15-13-22)19-21-8-9-24-18-25(11-10-23(24)17-21)30-16-4-7-20-5-2-1-3-6-20/h1-3,5-6,8-11,17-18,22H,4,7,12-16,19H2,(H,28,29)