(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1S)-1-(2-methylphenyl)ethyl]azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(1S)-1-(2-methylphenyl)ethyl]azanium Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-[(1S)-1-(o-tolyl)ethyl]ammonium CAS Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-[(1S)-1-(2-methylphenyl)ethyl]ammonium IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-[(1S)-1-(2-methylphenyl)ethyl]azanium Traditional Name: (7-chloro-4-keto-1H-quinazolin-2-yl)methyl-[(1S)-1-(o-tolyl)ethyl]ammonium Formula: C18H19ClN3O+ MolecularWeight: 328.81596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)[NH2+]CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1[C@H](C)[NH2+]CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O/c1-11-5-3-4-6-14(11)12(2)20-10-17-21-16-9-13(19)7-8-15(16)18(23)22-17/h3-9,12,20H,10H2,1-2H3,(H,21,22,23)/p+1/t12-/m0/s1