N-[2-[2-(1H-indol-3-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[2-[2-(1H-indol-3-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[2-[2-(1H-indole-3-carbonyl)hydrazino]-2-oxo-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[2-[[1H-indol-3-yl(oxo)methyl]hydrazo]-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[2-[2-(1H-indole-3-carbonyl)hydrazinyl]-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[2-[N'-(1H-indole-3-carbonyl)hydrazino]-2-keto-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NNC(=O)C1=CNC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(CC(=O)NNC(=O)C1=CNC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H22N4O6S/c1-25(32(28,29)14-7-8-18-19(11-14)31-10-4-9-30-18)13-20(26)23-24-21(27)16-12-22-17-6-3-2-5-15(16)17/h2-3,5-8,11-12,22H,4,9-10,13H2,1H3,(H,23,26)(H,24,27)