4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine

Systemtic Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine Openeye Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine CAS Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)-1-butanamine IUPAC Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine Traditional Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butylamine Formula: C13H19N3O2 MolecularWeight: 249.30886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)[N+](=O)[O-])CCCCN

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)[N+](=O)[O-])CCCCN

InChI

InChI=1S/C13H19N3O2/c14-6-1-2-7-15-8-5-11-3-4-13(16(17)18)9-12(11)10-15/h3-4,9H,1-2,5-8,10,14H2