1-[4-[6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanoyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[4-[6,7-dimethoxy-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanoyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-[4-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)butanoyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[4-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)-1-oxobutyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-(6,7-dimethoxy-2,4-dioxo-1H-quinazolin-3-yl)butanoyl]-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-[4-(2,4-diketo-6,7-dimethoxy-1H-quinazolin-3-yl)butanoyl]-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C25H36N5O6+ MolecularWeight: 502.58324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCC(=O)N3CCC(CC3)(C(=O)N)[NH+]4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCC(=O)N3CCC(CC3)(C(=O)N)[NH+]4CCCCC4)OC

InChI

InChI=1S/C25H35N5O6/c1-35-19-15-17-18(16-20(19)36-2)27-24(34)30(22(17)32)12-6-7-21(31)28-13-8-25(9-14-28,23(26)33)29-10-4-3-5-11-29/h15-16H,3-14H2,1-2H3,(H2,26,33)(H,27,34)/p+1