9-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide

Systemtic Name: 9-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide Openeye Name: 9-[1-(3H-benzimidazol-5-ylmethyl)-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide CAS Name: 9-[3-(3H-benzimidazol-5-yl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide IUPAC Name: 9-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide Traditional Name: 9-[1-(3H-benzimidazol-5-ylmethyl)-2-keto-2-(4-methylpiperidino)ethyl]-9-methyl-5,6,7,8-tetrahydrocarbazol-9-ium-3-sulfonamide Formula: C29H36N5O3S+ MolecularWeight: 534.69284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)[N+]4(C5=C(CCCC5)C6=C4C=CC(=C6)S(=O)(=O)N)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)[N+]4(C5=C(CCCC5)C6=C4C=CC(=C6)S(=O)(=O)N)C

InChI

InChI=1S/C29H36N5O3S/c1-19-11-13-33(14-12-19)29(35)28(16-20-7-9-24-25(15-20)32-18-31-24)34(2)26-6-4-3-5-22(26)23-17-21(38(30,36)37)8-10-27(23)34/h7-10,15,17-19,28H,3-6,11-14,16H2,1-2H3,(H,31,32)(H2,30,36,37)/q+1