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

Systemtic Name: 5-[4-(phenylmethyl)piperidin-1-yl]carbonylthiophene-2-carboxylic acid Openeye Name: 5-(4-benzylpiperidine-1-carbonyl)thiophene-2-carboxylic acid CAS Name: 5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-(4-benzylpiperidine-1-carbonyl)thiophene-2-carboxylic acid Traditional Name: 5-(4-benzylpiperidine-1-carbonyl)-2-thenoic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC=C(S3)C(=O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C18H19NO3S/c20-17(15-6-7-16(23-15)18(21)22)19-10-8-14(9-11-19)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H,21,22)