4-bromanyl-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide

Systemtic Name: 4-bromanyl-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide Openeye Name: 4-bromo-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide CAS Name: 4-bromo-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide IUPAC Name: 4-bromo-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide Traditional Name: 4-bromo-N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)benzohydrazide Formula: C16H15BrN2O5S MolecularWeight: 427.2697

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O5S/c17-12-4-2-11(3-5-12)16(20)18-19-25(21,22)13-6-7-14-15(10-13)24-9-1-8-23-14/h2-7,10,19H,1,8-9H2,(H,18,20)