N-(2-methylpropyl)-8-nitro-isoquinolin-5-amine

Systemtic Name: N-(2-methylpropyl)-8-nitro-isoquinolin-5-amine Openeye Name: N-isobutyl-8-nitro-isoquinolin-5-amine CAS Name: N-(2-methylpropyl)-8-nitro-5-isoquinolinamine IUPAC Name: N-(2-methylpropyl)-8-nitroisoquinolin-5-amine Traditional Name: isobutyl-(8-nitro-5-isoquinolyl)amine Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC1=C2C=CN=CC2=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O2/c1-9(2)7-15-12-3-4-13(16(17)18)11-8-14-6-5-10(11)12/h3-6,8-9,15H,7H2,1-2H3