3-[(4-cyano-7-methyl-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-cyano-7-methyl-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-cyano-7-methyl-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-cyano-7-methyl-1-(1-pyrrolidinyl)-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-cyano-7-methyl-1-pyrrolidin-1-yl-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-cyano-7-methyl-1-pyrrolidino-5,6,7,8-tetrahydro-2,7-naphthyridine-2,7-diium-3-yl)amino]propyl-dimethyl-ammonium Formula: C19H33N6+3 MolecularWeight: 345.50552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)N3CCCC3)NCCC[NH+](C)C)C#N

Isomeric SMILES

C[NH+]1CCC2=C(C(=[NH+]C(=C2C1)N3CCCC3)NCCC[NH+](C)C)C#N

InChI

InChI=1S/C19H30N6/c1-23(2)9-6-8-21-18-16(13-20)15-7-12-24(3)14-17(15)19(22-18)25-10-4-5-11-25/h4-12,14H2,1-3H3,(H,21,22)/p+3