5-[[1-(phenylmethyl)piperidin-4-yl]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[1-(phenylmethyl)piperidin-4-yl]methyl]furan-2-carboxylic acid Openeye Name: 5-[(1-benzyl-4-piperidyl)methyl]furan-2-carboxylic acid CAS Name: 5-[[1-(phenylmethyl)-4-piperidinyl]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(1-benzylpiperidin-4-yl)methyl]furan-2-carboxylic acid Traditional Name: 5-[(1-benzyl-4-piperidyl)methyl]-2-furoic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=C(O2)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CC2=CC=C(O2)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C18H21NO3/c20-18(21)17-7-6-16(22-17)12-14-8-10-19(11-9-14)13-15-4-2-1-3-5-15/h1-7,14H,8-13H2,(H,20,21)