[(1S)-1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-methyl-azanium

Systemtic Name: [(1S)-1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-methyl-azanium Openeye Name: [(1S)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-methyl-ammonium CAS Name: [(1S)-1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-methylammonium IUPAC Name: [(1S)-1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-methylazanium Traditional Name: [(1S)-1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-methyl-ammonium Formula: C19H22N3O+ MolecularWeight: 308.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)[NH2+]C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2[C@H](C)[NH2+]C)C

InChI

InChI=1S/C19H21N3O/c1-12-9-10-15(11-13(12)2)22-18(14(3)20-4)21-17-8-6-5-7-16(17)19(22)23/h5-11,14,20H,1-4H3/p+1/t14-/m0/s1