5-(4-methyl-1,4-diazepan-1-yl)-8-nitro-isoquinoline

Systemtic Name: 5-(4-methyl-1,4-diazepan-1-yl)-8-nitro-isoquinoline Openeye Name: 5-(4-methyl-1,4-diazepan-1-yl)-8-nitro-isoquinoline CAS Name: 5-(4-methyl-1,4-diazepan-1-yl)-8-nitroisoquinoline IUPAC Name: 5-(4-methyl-1,4-diazepan-1-yl)-8-nitroisoquinoline Traditional Name: 5-(4-methyl-1,4-diazepan-1-yl)-8-nitro-isoquinoline Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCCN(CC1)C2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O2/c1-17-7-2-8-18(10-9-17)14-3-4-15(19(20)21)13-11-16-6-5-12(13)14/h3-6,11H,2,7-10H2,1H3