6-bromanyl-3-(2,4-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: 6-bromanyl-3-(2,4-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(2,4-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-3-(2,4-dimethoxyphenyl)-N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-3-(2,4-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-3-(2,4-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-keto-1H-quinazoline-4-carboxamide Formula: C24H30BrN4O5+ MolecularWeight: 534.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=C(C=C(C=C4)OC)OC)O

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C2(C3=C(C=CC(=C3)Br)NC(=O)N2C4=C(C=C(C=C4)OC)OC)O

InChI

InChI=1S/C24H29BrN4O5/c1-4-28-11-5-6-16(28)14-26-22(30)24(32)18-12-15(25)7-9-19(18)27-23(31)29(24)20-10-8-17(33-2)13-21(20)34-3/h7-10,12-13,16,32H,4-6,11,14H2,1-3H3,(H,26,30)(H,27,31)/p+1