5-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]sulfonyl-1,3-dihydroindol-2-one

Systemtic Name: 5-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]sulfonyl-1,3-dihydroindol-2-one Openeye Name: 5-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]sulfonylindolin-2-one CAS Name: 5-[[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]sulfonyl]-1,3-dihydroindol-2-one IUPAC Name: 5-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]sulfonyl-1,3-dihydroindol-2-one Traditional Name: 5-[4-(3-chlorobenzyl)piperazin-4-ium-1-yl]sulfonyloxindole Formula: C19H21ClN3O3S+ MolecularWeight: 406.90634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

InChI

InChI=1S/C19H20ClN3O3S/c20-16-3-1-2-14(10-16)13-22-6-8-23(9-7-22)27(25,26)17-4-5-18-15(11-17)12-19(24)21-18/h1-5,10-11H,6-9,12-13H2,(H,21,24)/p+1