N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-4-nitro-benzohydrazide

Systemtic Name: N'-[4-(azepan-1-ylsulfonyl)phenyl]carbonyl-4-nitro-benzohydrazide Openeye Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-4-nitro-benzohydrazide CAS Name: N'-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-4-nitrobenzohydrazide Traditional Name: N'-[4-(azepan-1-ylsulfonyl)benzoyl]-4-nitro-benzohydrazide Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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