4-(azepan-1-ylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzohydrazide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzohydrazide Openeye Name: 4-(azepan-1-ylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzohydrazide CAS Name: 4-(1-azepanylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]benzohydrazide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzohydrazide Traditional Name: 4-(azepan-1-ylsulfonyl)-N'-[(E)-3-(4-nitrophenyl)acryloyl]benzohydrazide Formula: C22H24N4O6S MolecularWeight: 472.51416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O6S/c27-21(14-7-17-5-10-19(11-6-17)26(29)30)23-24-22(28)18-8-12-20(13-9-18)33(31,32)25-15-3-1-2-4-16-25/h5-14H,1-4,15-16H2,(H,23,27)(H,24,28)/b14-7+