3-[(4-ethoxyphenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide

Systemtic Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide Openeye Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]propanamide IUPAC Name: 3-[(4-ethoxyphenyl)sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]propanamide Traditional Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(p-phenetylsulfonylamino)propionamide Formula: C23H38N3O4S+ MolecularWeight: 452.63052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C23H37N3O4S/c1-2-30-20-9-11-21(12-10-20)31(28,29)25-16-13-22(27)24-19-23(14-5-3-6-15-23)26-17-7-4-8-18-26/h9-12,25H,2-8,13-19H2,1H3,(H,24,27)/p+1