(1-methylindol-3-yl)methyl-[[3-(methylsulfonylamino)-5-piperidin-1-ylcarbonyl-phenyl]methyl]azanium

Systemtic Name: (1-methylindol-3-yl)methyl-[[3-(methylsulfonylamino)-5-piperidin-1-ylcarbonyl-phenyl]methyl]azanium Openeye Name: [3-(methanesulfonamido)-5-(piperidine-1-carbonyl)phenyl]methyl-[(1-methylindol-3-yl)methyl]ammonium CAS Name: [3-(methanesulfonamido)-5-[oxo(1-piperidinyl)methyl]phenyl]methyl-[(1-methyl-3-indolyl)methyl]ammonium IUPAC Name: [3-(methanesulfonamido)-5-(piperidine-1-carbonyl)phenyl]methyl-[(1-methylindol-3-yl)methyl]azanium Traditional Name: [3-(methanesulfonamido)-5-(piperidine-1-carbonyl)benzyl]-[(1-methylindol-3-yl)methyl]ammonium Formula: C24H31N4O3S+ MolecularWeight: 455.59294

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C[NH2+]CC3=CC(=CC(=C3)C(=O)N4CCCCC4)NS(=O)(=O)C

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[NH2+]CC3=CC(=CC(=C3)C(=O)N4CCCCC4)NS(=O)(=O)C

InChI

InChI=1S/C24H30N4O3S/c1-27-17-20(22-8-4-5-9-23(22)27)16-25-15-18-12-19(14-21(13-18)26-32(2,30)31)24(29)28-10-6-3-7-11-28/h4-5,8-9,12-14,17,25-26H,3,6-7,10-11,15-16H2,1-2H3/p+1