[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)OC

InChI

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