7-nitro-3-[(6-nitroquinolin-2-yl)methyl]-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 7-nitro-3-[(6-nitroquinolin-2-yl)methyl]-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 7-nitro-3-[(6-nitro-2-quinolyl)methyl]-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 7-nitro-3-[(6-nitro-2-quinolinyl)methyl]-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 7-nitro-3-[(6-nitroquinolin-2-yl)methyl]-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 7-nitro-3-[(6-nitro-2-quinolyl)methyl]-1,2,4,5-tetrahydro-3-benzazepine Formula: C20H18N4O4 MolecularWeight: 378.38132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=C1C=CC(=C2)[N+](=O)[O-])CC3=NC4=C(C=C3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC2=C1C=CC(=C2)[N+](=O)[O-])CC3=NC4=C(C=C3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4/c25-23(26)18-4-2-14-7-9-22(10-8-15(14)11-18)13-17-3-1-16-12-19(24(27)28)5-6-20(16)21-17/h1-6,11-12H,7-10,13H2