3-chloranyl-6-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(1-isopropylpiperidin-1-ium-4-yl)-6-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(1-isopropylpiperidin-1-ium-4-yl)-6-methyl-benzothiophene-2-carboxamide Formula: C18H24ClN2OS+ MolecularWeight: 351.91396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3CC[NH+](CC3)C(C)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC3CC[NH+](CC3)C(C)C)Cl

InChI

InChI=1S/C18H23ClN2OS/c1-11(2)21-8-6-13(7-9-21)20-18(22)17-16(19)14-5-4-12(3)10-15(14)23-17/h4-5,10-11,13H,6-9H2,1-3H3,(H,20,22)/p+1