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

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[2-(3,5-dimethylphenoxy)ethyl]-methyl-azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-[2-(3,5-dimethylphenoxy)ethyl]-methyl-ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[2-(3,5-dimethylphenoxy)ethyl]-methylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[2-(3,5-dimethylphenoxy)ethyl]-methylazanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-[2-(3,5-dimethylphenoxy)ethyl]-methyl-ammonium Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)C

InChI

InChI=1S/C22H26N4O3/c1-15-10-16(2)12-17(11-15)29-9-8-25(3)14-21-24-19-7-5-4-6-18(19)22(28)26(21)13-20(23)27/h4-7,10-12H,8-9,13-14H2,1-3H3,(H2,23,27)/p+1