N-[3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide

Systemtic Name: N-[3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Openeye Name: N-[3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide CAS Name: N-[3-[(4-methyl-1-piperidin-1-iumyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide IUPAC Name: N-[3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide Traditional Name: N-[3-[(4-methylpiperidin-1-ium-1-yl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzamide Formula: C22H29N2OS+ MolecularWeight: 369.54346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H28N2OS/c1-16-11-13-24(14-12-16)15-19-18-9-5-6-10-20(18)26-22(19)23-21(25)17-7-3-2-4-8-17/h2-4,7-8,16H,5-6,9-15H2,1H3,(H,23,25)/p+1