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

Systemtic Name: 3-(3,4-dimethylphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 3-(3,4-dimethylphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide CAS Name: 3-(3,4-dimethylphenyl)-N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 3-(3,4-dimethylphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 3-(3,4-dimethylphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-keto-1H-quinazoline-4-carboxamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2(C3=CC=CC=C3NC(=O)N2C4=CC(=C(C=C4)C)C)O

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C2(C3=CC=CC=C3NC(=O)N2C4=CC(=C(C=C4)C)C)O

InChI

InChI=1S/C24H30N4O3/c1-4-27-13-7-8-19(27)15-25-22(29)24(31)20-9-5-6-10-21(20)26-23(30)28(24)18-12-11-16(2)17(3)14-18/h5-6,9-12,14,19,31H,4,7-8,13,15H2,1-3H3,(H,25,29)(H,26,30)/p+1