8-nitro-N-(phenylmethyl)isoquinolin-5-amine

Systemtic Name: 8-nitro-N-(phenylmethyl)isoquinolin-5-amine Openeye Name: N-benzyl-8-nitro-isoquinolin-5-amine CAS Name: 8-nitro-N-(phenylmethyl)-5-isoquinolinamine IUPAC Name: N-benzyl-8-nitroisoquinolin-5-amine Traditional Name: benzyl-(8-nitro-5-isoquinolyl)amine Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2/c20-19(21)16-7-6-15(13-8-9-17-11-14(13)16)18-10-12-4-2-1-3-5-12/h1-9,11,18H,10H2