5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-3H-indol-2-one

Systemtic Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-3H-indol-2-one Openeye Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-indolin-2-one CAS Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-3H-indol-2-one IUPAC Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-3H-indol-2-one Traditional Name: 5-(1,4-diazepan-4-ium-1-ylsulfonyl)-1-methyl-oxindole Formula: C14H20N3O3S+ MolecularWeight: 310.3919

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)N3CCC[NH2+]CC3

Isomeric SMILES

CN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)N3CCC[NH2+]CC3

InChI

InChI=1S/C14H19N3O3S/c1-16-13-4-3-12(9-11(13)10-14(16)18)21(19,20)17-7-2-5-15-6-8-17/h3-4,9,15H,2,5-8,10H2,1H3/p+1