N-[3-[2-(4-bromophenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[3-[2-(4-bromophenyl)carbonylhydrazinyl]-3-oxidanylidene-propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[3-[2-(4-bromobenzoyl)hydrazino]-3-oxo-propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[3-[[(4-bromophenyl)-oxomethyl]hydrazo]-3-oxopropyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[3-[2-(4-bromobenzoyl)hydrazinyl]-3-oxopropyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[3-[N'-(4-bromobenzoyl)hydrazino]-3-keto-propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C18H18BrN3O6S MolecularWeight: 484.32102

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC(=O)NNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O6S/c19-13-3-1-12(2-4-13)18(24)22-21-17(23)7-8-20-29(25,26)14-5-6-15-16(11-14)28-10-9-27-15/h1-6,11,20H,7-10H2,(H,21,23)(H,22,24)