1-(azepan-1-yl)-2-(6-nitroindazol-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(6-nitroindazol-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(6-nitroindazol-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(6-nitro-1-indazolyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(6-nitroindazol-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(6-nitroindazol-1-yl)ethanone Formula: C15H18N4O3 MolecularWeight: 302.32842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

InChI

InChI=1S/C15H18N4O3/c20-15(17-7-3-1-2-4-8-17)11-18-14-9-13(19(21)22)6-5-12(14)10-16-18/h5-6,9-10H,1-4,7-8,11H2