6,7-diethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-1H-quinazoline-2,4-dione

Systemtic Name: 6,7-diethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-1H-quinazoline-2,4-dione Openeye Name: 6,7-diethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-1H-quinazoline-2,4-dione CAS Name: 6,7-diethoxy-3-[2-(2-methyl-1-piperidin-1-iumyl)ethyl]-1H-quinazoline-2,4-dione IUPAC Name: 6,7-diethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-1H-quinazoline-2,4-dione Traditional Name: 6,7-diethoxy-3-[2-(2-methylpiperidin-1-ium-1-yl)ethyl]-1H-quinazoline-2,4-quinone Formula: C20H30N3O4+ MolecularWeight: 376.4699

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CC[NH+]3CCCCC3C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CC[NH+]3CCCCC3C)OCC

InChI

InChI=1S/C20H29N3O4/c1-4-26-17-12-15-16(13-18(17)27-5-2)21-20(25)23(19(15)24)11-10-22-9-7-6-8-14(22)3/h12-14H,4-11H2,1-3H3,(H,21,25)/p+1