N-(3,4-dimethylphenyl)-8-nitro-isoquinolin-5-amine

Systemtic Name: N-(3,4-dimethylphenyl)-8-nitro-isoquinolin-5-amine Openeye Name: N-(3,4-dimethylphenyl)-8-nitro-isoquinolin-5-amine CAS Name: N-(3,4-dimethylphenyl)-8-nitro-5-isoquinolinamine IUPAC Name: N-(3,4-dimethylphenyl)-8-nitroisoquinolin-5-amine Traditional Name: (3,4-dimethylphenyl)-(8-nitro-5-isoquinolyl)amine Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N3O2/c1-11-3-4-13(9-12(11)2)19-16-5-6-17(20(21)22)15-10-18-8-7-14(15)16/h3-10,19H,1-2H3