[(1R)-1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-propyl-azanium

Systemtic Name: [(1R)-1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-propyl-azanium Openeye Name: [(1R)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-propyl-ammonium CAS Name: [(1R)-1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]propyl]-propylammonium IUPAC Name: [(1R)-1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]propyl]-propylazanium Traditional Name: [(1R)-1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]propyl]-propyl-ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCC[NH2+][C@H](CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H27N3O/c1-5-13-23-19(6-2)21-24-20-10-8-7-9-18(20)22(26)25(21)17-12-11-15(3)16(4)14-17/h7-12,14,19,23H,5-6,13H2,1-4H3/p+1/t19-/m1/s1