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

Systemtic Name: N-(3,4-dimethoxyphenyl)-8-nitro-isoquinolin-5-amine Openeye Name: N-(3,4-dimethoxyphenyl)-8-nitro-isoquinolin-5-amine CAS Name: N-(3,4-dimethoxyphenyl)-8-nitro-5-isoquinolinamine IUPAC Name: N-(3,4-dimethoxyphenyl)-8-nitroisoquinolin-5-amine Traditional Name: (3,4-dimethoxyphenyl)-(8-nitro-5-isoquinolyl)amine Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H15N3O4/c1-23-16-6-3-11(9-17(16)24-2)19-14-4-5-15(20(21)22)13-10-18-8-7-12(13)14/h3-10,19H,1-2H3