3-(4-ethylphenyl)-4-oxidanyl-2-oxidanylidene-N-(3-pyrrolidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide

Systemtic Name: 3-(4-ethylphenyl)-4-oxidanyl-2-oxidanylidene-N-(3-pyrrolidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Openeye Name: 3-(4-ethylphenyl)-4-hydroxy-2-oxo-N-(3-pyrrolidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide CAS Name: 3-(4-ethylphenyl)-4-hydroxy-2-oxo-N-[3-(1-pyrrolidin-1-iumyl)propyl]-1H-quinazoline-4-carboxamide IUPAC Name: 3-(4-ethylphenyl)-4-hydroxy-2-oxo-N-(3-pyrrolidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Traditional Name: 3-(4-ethylphenyl)-4-hydroxy-2-keto-N-(3-pyrrolidin-1-ium-1-ylpropyl)-1H-quinazoline-4-carboxamide Formula: C24H31N4O3+ MolecularWeight: 423.52794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)NCCC[NH+]4CCCC4)O

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)NC3=CC=CC=C3C2(C(=O)NCCC[NH+]4CCCC4)O

InChI

InChI=1S/C24H30N4O3/c1-2-18-10-12-19(13-11-18)28-23(30)26-21-9-4-3-8-20(21)24(28,31)22(29)25-14-7-17-27-15-5-6-16-27/h3-4,8-13,31H,2,5-7,14-17H2,1H3,(H,25,29)(H,26,30)/p+1