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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4/c27-21(23-24-22(28)18-8-12-20(13-9-18)26(29)30)14-7-17-5-10-19(11-6-17)25-15-3-1-2-4-16-25/h5-14H,1-4,15-16H2,(H,23,27)(H,24,28)/b14-7+