N-(1-propan-2-ylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide

Systemtic Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide CAS Name: N-(1-propan-2-yl-4-piperidin-1-iumyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide IUPAC Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Formula: C18H29N2OS+ MolecularWeight: 321.50066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC3=C(S2)CCCCC3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC3=C(S2)CCCCC3

InChI

InChI=1S/C18H28N2OS/c1-13(2)20-10-8-15(9-11-20)19-18(21)17-12-14-6-4-3-5-7-16(14)22-17/h12-13,15H,3-11H2,1-2H3,(H,19,21)/p+1