N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-5-propan-2-yl-thiophene-3-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-5-propan-2-yl-thiophene-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-isopropyl-thiophene-3-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-5-propan-2-yl-3-thiophenecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-propan-2-ylthiophene-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-isopropyl-thiophene-3-carboxamide Formula: C20H27N2OS+ MolecularWeight: 343.50618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CS1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC(=CS1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2OS/c1-15(2)19-12-17(14-24-19)20(23)21-18-8-10-22(11-9-18)13-16-6-4-3-5-7-16/h3-7,12,14-15,18H,8-11,13H2,1-2H3,(H,21,23)/p+1