N-[(5-nitrofuran-2-yl)methyl]isoquinolin-5-amine

Systemtic Name: N-[(5-nitrofuran-2-yl)methyl]isoquinolin-5-amine Openeye Name: N-[(5-nitro-2-furyl)methyl]isoquinolin-5-amine CAS Name: N-[(5-nitro-2-furanyl)methyl]-5-isoquinolinamine IUPAC Name: N-[(5-nitrofuran-2-yl)methyl]isoquinolin-5-amine Traditional Name: 5-isoquinolyl-[(5-nitro-2-furyl)methyl]amine Formula: C14H11N3O3 MolecularWeight: 269.25544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NCC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NCC3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O3/c18-17(19)14-5-4-11(20-14)9-16-13-3-1-2-10-8-15-7-6-12(10)13/h1-8,16H,9H2