[(1R)-1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-(2-methylpropyl)azanium

Systemtic Name: [(1R)-1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-(2-methylpropyl)azanium Openeye Name: isobutyl-[(1R)-1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]propyl]ammonium CAS Name: [(1R)-1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]propyl]-(2-methylpropyl)ammonium IUPAC Name: [(1R)-1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]propyl]-(2-methylpropyl)azanium Traditional Name: isobutyl-[(1R)-1-[4-keto-3-(p-tolyl)quinazolin-2-yl]propyl]ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O/c1-5-19(23-14-15(2)3)21-24-20-9-7-6-8-18(20)22(26)25(21)17-12-10-16(4)11-13-17/h6-13,15,19,23H,5,14H2,1-4H3/p+1/t19-/m1/s1