1-(5-nitroisoquinolin-1-yl)-N-(phenylmethyl)methanimine

Systemtic Name: 1-(5-nitroisoquinolin-1-yl)-N-(phenylmethyl)methanimine Openeye Name: N-benzyl-1-(5-nitro-1-isoquinolyl)methanimine CAS Name: 1-(5-nitro-1-isoquinolinyl)-N-(phenylmethyl)methanimine IUPAC Name: N-benzyl-1-(5-nitroisoquinolin-1-yl)methanimine Traditional Name: benzyl-[(5-nitro-1-isoquinolyl)methylene]amine Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=CC2=NC=CC3=C2C=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN=CC2=NC=CC3=C2C=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O2/c21-20(22)17-8-4-7-14-15(17)9-10-19-16(14)12-18-11-13-5-2-1-3-6-13/h1-10,12H,11H2