N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-nitro-pyridin-2-amine

Systemtic Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-nitro-pyridin-2-amine Openeye Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-nitro-pyridin-2-amine CAS Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-nitro-2-pyridinamine IUPAC Name: N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-5-nitropyridin-2-amine Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl-(5-nitro-2-pyridyl)amine Formula: C17H20N4O2 MolecularWeight: 312.3663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O2/c22-21(23)16-6-7-17(19-12-16)18-9-3-10-20-11-8-14-4-1-2-5-15(14)13-20/h1-2,4-7,12H,3,8-11,13H2,(H,18,19)