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

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(4-dimethylaminophenyl)methyl]-ethyl-azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(4-dimethylaminophenyl)methyl]-ethyl-ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(4-dimethylaminophenyl)methyl]-ethylammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(4-dimethylaminophenyl)methyl]-ethylazanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C22H29N4O3+ MolecularWeight: 397.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC[NH+](CC1=CC=C(C=C1)N(C)C)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C22H28N4O3/c1-6-26(13-15-7-9-16(10-8-15)25(2)3)14-21-23-18-12-20(29-5)19(28-4)11-17(18)22(27)24-21/h7-12H,6,13-14H2,1-5H3,(H,23,24,27)/p+1