3-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[[4-(hydroxymethyl)-1-piperidyl]methyl]benzothiophene-2-carboxylic acid CAS Name: 3-[[4-(hydroxymethyl)-1-piperidinyl]methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[(4-methylolpiperidino)methyl]benzothiophene-2-carboxylic acid Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)CC2=C(SC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CN(CCC1CO)CC2=C(SC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H19NO3S/c18-10-11-5-7-17(8-6-11)9-13-12-3-1-2-4-14(12)21-15(13)16(19)20/h1-4,11,18H,5-10H2,(H,19,20)