4-[(4-chloranyl-2-methyl-phenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[(4-chloranyl-2-methyl-phenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide Openeye Name: 4-[(4-chloro-2-methyl-phenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide CAS Name: 4-[(4-chloro-2-methylphenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide IUPAC Name: 4-[(4-chloro-2-methylphenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide Traditional Name: 4-[(4-chloro-2-methyl-phenoxy)methyl]-N-[2-(1H-indol-1-ium-3-yl)ethyl]benzenesulfonamide Formula: C24H24ClN2O3S+ MolecularWeight: 455.97696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)S(=O)(=O)NCCC3=C[NH2+]C4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)S(=O)(=O)NCCC3=C[NH2+]C4=CC=CC=C43

InChI

InChI=1S/C24H23ClN2O3S/c1-17-14-20(25)8-11-24(17)30-16-18-6-9-21(10-7-18)31(28,29)27-13-12-19-15-26-23-5-3-2-4-22(19)23/h2-11,14-15,26-27H,12-13,16H2,1H3/p+1