N-[3-[2-(2-bromophenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[3-[2-(2-bromophenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[2-(2-bromobenzoyl)hydrazino]-3-oxo-propyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[[(2-bromophenyl)-oxomethyl]hydrazo]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[2-(2-bromobenzoyl)hydrazinyl]-3-oxopropyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[N'-(2-bromobenzoyl)hydrazino]-3-keto-propyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H20BrN3O6S MolecularWeight: 498.3476

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC=CC=C3Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC=CC=C3Br)OC1

InChI

InChI=1S/C19H20BrN3O6S/c20-15-5-2-1-4-14(15)19(25)23-22-18(24)8-9-21-30(26,27)13-6-7-16-17(12-13)29-11-3-10-28-16/h1-2,4-7,12,21H,3,8-11H2,(H,22,24)(H,23,25)