N'-[3-(4-nitrophenyl)propanoyl]-N-(phenylsulfonyl)azepane-1-carbohydrazide

Systemtic Name: N'-[3-(4-nitrophenyl)propanoyl]-N-(phenylsulfonyl)azepane-1-carbohydrazide Openeye Name: N-(benzenesulfonyl)-N'-[3-(4-nitrophenyl)propanoyl]azepane-1-carbohydrazide CAS Name: N-(benzenesulfonyl)-N'-[3-(4-nitrophenyl)-1-oxopropyl]-1-azepanecarbohydrazide IUPAC Name: N-(benzenesulfonyl)-N'-[3-(4-nitrophenyl)propanoyl]azepane-1-carbohydrazide Traditional Name: N-besyl-N'-[3-(4-nitrophenyl)propanoyl]azepane-1-carbohydrazide Formula: C22H26N4O6S MolecularWeight: 474.53004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)N(NC(=O)CCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)N(NC(=O)CCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O6S/c27-21(15-12-18-10-13-19(14-11-18)26(29)30)23-25(22(28)24-16-6-1-2-7-17-24)33(31,32)20-8-4-3-5-9-20/h3-5,8-11,13-14H,1-2,6-7,12,15-17H2,(H,23,27)