[(1R)-1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-pentyl-azanium

Systemtic Name: [(1R)-1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-pentyl-azanium Openeye Name: [(1R)-1-[3-(m-tolyl)-4-oxo-quinazolin-2-yl]ethyl]-pentyl-ammonium CAS Name: [(1R)-1-[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-pentylammonium IUPAC Name: [(1R)-1-[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-pentylazanium Traditional Name: amyl-[(1R)-1-[4-keto-3-(m-tolyl)quinazolin-2-yl]ethyl]ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O/c1-4-5-8-14-23-17(3)21-24-20-13-7-6-12-19(20)22(26)25(21)18-11-9-10-16(2)15-18/h6-7,9-13,15,17,23H,4-5,8,14H2,1-3H3/p+1/t17-/m1/s1