5-(azepan-1-ylsulfonyl)-N'-[2-(4-bromanylphenoxy)ethanoyl]-2-methoxy-benzohydrazide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N'-[2-(4-bromanylphenoxy)ethanoyl]-2-methoxy-benzohydrazide Openeye Name: 5-(azepan-1-ylsulfonyl)-N'-[2-(4-bromophenoxy)acetyl]-2-methoxy-benzohydrazide CAS Name: 5-(1-azepanylsulfonyl)-N'-[2-(4-bromophenoxy)-1-oxoethyl]-2-methoxybenzohydrazide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N'-[2-(4-bromophenoxy)acetyl]-2-methoxybenzohydrazide Traditional Name: 5-(azepan-1-ylsulfonyl)-N'-[2-(4-bromophenoxy)acetyl]-2-methoxy-benzohydrazide Formula: C22H26BrN3O6S MolecularWeight: 540.42734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NNC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H26BrN3O6S/c1-31-20-11-10-18(33(29,30)26-12-4-2-3-5-13-26)14-19(20)22(28)25-24-21(27)15-32-17-8-6-16(23)7-9-17/h6-11,14H,2-5,12-13,15H2,1H3,(H,24,27)(H,25,28)