(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(3-ethylanilino)-2-oxo-ethyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(3-ethylanilino)-2-oxoethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(3-ethylanilino)-2-oxoethyl]azanium Traditional Name: ethyl-[2-(3-ethylanilino)-2-keto-ethyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C[NH+](CC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C[NH+](CC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C23H28N4O4/c1-5-15-8-7-9-16(10-15)24-22(28)14-27(6-2)13-21-25-18-12-20(31-4)19(30-3)11-17(18)23(29)26-21/h7-12H,5-6,13-14H2,1-4H3,(H,24,28)(H,25,26,29)/p+1