5-(azepan-1-yl)-8-nitro-isoquinoline

Systemtic Name: 5-(azepan-1-yl)-8-nitro-isoquinoline Openeye Name: 5-(azepan-1-yl)-8-nitro-isoquinoline CAS Name: 5-(1-azepanyl)-8-nitroisoquinoline IUPAC Name: 5-(azepan-1-yl)-8-nitroisoquinoline Traditional Name: 5-(azepan-1-yl)-8-nitro-isoquinoline Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O2/c19-18(20)15-6-5-14(12-7-8-16-11-13(12)15)17-9-3-1-2-4-10-17/h5-8,11H,1-4,9-10H2