(4-dimethylaminophenyl)methyl-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-methyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-methyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]-methyl-ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+](C)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H24N4O/c1-14(19-21-18-8-6-5-7-17(18)20(25)22-19)24(4)13-15-9-11-16(12-10-15)23(2)3/h5-12,14H,13H2,1-4H3,(H,21,22,25)/p+1/t14-/m1/s1