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

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

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C22H26N4O4/c1-25(11-10-15-8-9-18(29-2)19(12-15)30-3)14-21-24-17-7-5-4-6-16(17)22(28)26(21)13-20(23)27/h4-9,12H,10-11,13-14H2,1-3H3,(H2,23,27)/p+1