2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-[methyl-[(E)-styryl]sulfonyl-amino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide CAS Name: 2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Traditional Name: 2-[methyl-[(E)-styryl]sulfonyl-amino]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]acetamide Formula: C23H36N3O3S+ MolecularWeight: 434.61524

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1(CCCCC1)[NH+]2CCCCC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NCC1(CCCCC1)[NH+]2CCCCC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H35N3O3S/c1-25(30(28,29)18-13-21-11-5-2-6-12-21)19-22(27)24-20-23(14-7-3-8-15-23)26-16-9-4-10-17-26/h2,5-6,11-13,18H,3-4,7-10,14-17,19-20H2,1H3,(H,24,27)/p+1/b18-13+