3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide

Systemtic Name: 3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide Openeye Name: 3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide CAS Name: 3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide IUPAC Name: 3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide Traditional Name: 3-nitro-N'-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)benzohydrazide Formula: C13H17N4O3+ MolecularWeight: 277.29908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=[NH+]CC1)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O3/c18-13(10-5-4-6-11(9-10)17(19)20)16-15-12-7-2-1-3-8-14-12/h4-6,9H,1-3,7-8H2,(H,14,15)(H,16,18)/p+1