[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-(4,5-dimethoxy-2-methyl-benzyl)-methyl-ammonium Formula: C22H27N4O4+ MolecularWeight: 411.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)OC)OC

InChI

InChI=1S/C22H26N4O4/c1-14-9-18(29-3)19(30-4)10-15(14)11-25(2)13-21-24-17-8-6-5-7-16(17)22(28)26(21)12-20(23)27/h5-10H,11-13H2,1-4H3,(H2,23,27)/p+1