N-[(4-methylphenyl)methyl]-8-nitro-isoquinolin-5-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-8-nitro-isoquinolin-5-amine Openeye Name: 8-nitro-N-(p-tolylmethyl)isoquinolin-5-amine CAS Name: N-[(4-methylphenyl)methyl]-8-nitro-5-isoquinolinamine IUPAC Name: N-[(4-methylphenyl)methyl]-8-nitroisoquinolin-5-amine Traditional Name: (4-methylbenzyl)-(8-nitro-5-isoquinolyl)amine Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O2/c1-12-2-4-13(5-3-12)10-19-16-6-7-17(20(21)22)15-11-18-9-8-14(15)16/h2-9,11,19H,10H2,1H3