N'-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-3-nitro-benzohydrazide

Systemtic Name: N'-[3-(azepan-1-ylsulfonyl)phenyl]carbonyl-3-nitro-benzohydrazide Openeye Name: N'-[3-(azepan-1-ylsulfonyl)benzoyl]-3-nitro-benzohydrazide CAS Name: N'-[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]-3-nitrobenzohydrazide IUPAC Name: N'-[3-(azepan-1-ylsulfonyl)benzoyl]-3-nitrobenzohydrazide Traditional Name: N'-[3-(azepan-1-ylsulfonyl)benzoyl]-3-nitro-benzohydrazide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O6S/c25-19(15-7-5-9-17(13-15)24(27)28)21-22-20(26)16-8-6-10-18(14-16)31(29,30)23-11-3-1-2-4-12-23/h5-10,13-14H,1-4,11-12H2,(H,21,25)(H,22,26)