N-(1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethyl)-4-nitro-1-oxidanidyl-quinolin-1-ium-3-amine

Systemtic Name: N-(1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethyl)-4-nitro-1-oxidanidyl-quinolin-1-ium-3-amine Openeye Name: N-(1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethyl)-4-nitro-1-oxido-quinolin-1-ium-3-amine CAS Name: N-(1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethyl)-4-nitro-1-oxido-3-quinolin-1-iumamine IUPAC Name: N-(1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethyl)-4-nitro-1-oxidoquinolin-1-ium-3-amine Traditional Name: (4-nitro-1-oxido-quinolin-1-ium-3-yl)-(pyrrolizidin-8-ylmethyl)amine Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCCN2C1)CNC3=C(C4=CC=CC=C4[N+](=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC2(CCCN2C1)CNC3=C(C4=CC=CC=C4[N+](=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c22-20-11-14(16(21(23)24)13-5-1-2-6-15(13)20)18-12-17-7-3-9-19(17)10-4-8-17/h1-2,5-6,11,18H,3-4,7-10,12H2