3-(2-methoxyethyl)-4-oxidanylidene-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)quinazoline-2-carboxamide

Systemtic Name: 3-(2-methoxyethyl)-4-oxidanylidene-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)quinazoline-2-carboxamide Openeye Name: 3-(2-methoxyethyl)-4-oxo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)quinazoline-2-carboxamide CAS Name: 3-(2-methoxyethyl)-4-oxo-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-2-quinazolinecarboxamide IUPAC Name: 3-(2-methoxyethyl)-4-oxo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)quinazoline-2-carboxamide Traditional Name: 4-keto-3-(2-methoxyethyl)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)quinazoline-2-carboxamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NC3=CC=CC=C3C(=O)N2CCOC)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NC3=CC=CC=C3C(=O)N2CCOC)C

InChI

InChI=1S/C21H30N4O3/c1-20(2)12-14(13-21(3,4)24-20)22-18(26)17-23-16-9-7-6-8-15(16)19(27)25(17)10-11-28-5/h6-9,14,24H,10-13H2,1-5H3,(H,22,26)/p+1