N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-3-nitro-benzohydrazide

Systemtic Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-3-nitro-benzohydrazide Openeye Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-3-nitro-benzohydrazide CAS Name: N'-[(E)-3-[4-(1-azepanyl)phenyl]-1-oxoprop-2-enyl]-3-nitrobenzohydrazide IUPAC Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-3-nitrobenzohydrazide Traditional Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]acryloyl]-3-nitro-benzohydrazide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c27-21(23-24-22(28)18-6-5-7-20(16-18)26(29)30)13-10-17-8-11-19(12-9-17)25-14-3-1-2-4-15-25/h5-13,16H,1-4,14-15H2,(H,23,27)(H,24,28)/b13-10+