(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1R)-1-(2,5-dimethylphenyl)ethyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1R)-1-(2,5-dimethylphenyl)ethyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(2,5-dimethylphenyl)ethyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(2,5-dimethylphenyl)ethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(1R)-1-(2,5-dimethylphenyl)ethyl]azanium Traditional Name: [(1R)-1-(2,5-dimethylphenyl)ethyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)[NH2+]CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H](C)[NH2+]CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C21H25N3O3/c1-12-6-7-13(2)15(8-12)14(3)22-11-20-23-17-10-19(27-5)18(26-4)9-16(17)21(25)24-20/h6-10,14,22H,11H2,1-5H3,(H,23,24,25)/p+1/t14-/m1/s1