1-(azepan-1-yl)-2-(5-nitroindazol-1-yl)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(5-nitroindazol-1-yl)ethanone Openeye Name: 1-(azepan-1-yl)-2-(5-nitroindazol-1-yl)ethanone CAS Name: 1-(1-azepanyl)-2-(5-nitro-1-indazolyl)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(5-nitroindazol-1-yl)ethanone Traditional Name: 1-(azepan-1-yl)-2-(5-nitroindazol-1-yl)ethanone Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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