1-[[1-(2-methoxyethyl)-6-methyl-2-oxidanylidene-quinolin-3-yl]methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[1-(2-methoxyethyl)-6-methyl-2-oxidanylidene-quinolin-3-yl]methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[[1-(2-methoxyethyl)-6-methyl-2-oxo-3-quinolyl]methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide CAS Name: 1-[[1-(2-methoxyethyl)-6-methyl-2-oxo-3-quinolinyl]methyl]-4-(1-piperidin-1-iumyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[1-(2-methoxyethyl)-6-methyl-2-oxoquinolin-3-yl]methyl]-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[[2-keto-1-(2-methoxyethyl)-6-methyl-3-quinolyl]methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Formula: C25H38N4O3+2 MolecularWeight: 442.59422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=C2)C[NH+]3CCC(CC3)(C(=O)N)[NH+]4CCCCC4)CCOC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=C2)C[NH+]3CCC(CC3)(C(=O)N)[NH+]4CCCCC4)CCOC

InChI

InChI=1S/C25H36N4O3/c1-19-6-7-22-20(16-19)17-21(23(30)29(22)14-15-32-2)18-27-12-8-25(9-13-27,24(26)31)28-10-4-3-5-11-28/h6-7,16-17H,3-5,8-15,18H2,1-2H3,(H2,26,31)/p+2