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

Systemtic Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine dihydrochloride Openeye Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine dihydrochloride CAS Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)-1-butanamine dihydrochloride IUPAC Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine dihydrochloride Traditional Name: 4-(7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)butylamine dihydrochloride Formula: C13H21Cl2N3O2 MolecularWeight: 322.23074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O2.2ClH/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;2*1H