[(1R)-1-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-hexyl-azanium

Systemtic Name: [(1R)-1-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-hexyl-azanium Openeye Name: [(1R)-1-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-hexyl-ammonium CAS Name: [(1R)-1-[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]ethyl]-hexylammonium IUPAC Name: [(1R)-1-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]ethyl]-hexylazanium Traditional Name: [(1R)-1-[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]ethyl]-hexyl-ammonium Formula: C22H27ClN3O+ MolecularWeight: 384.92228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

Isomeric SMILES

CCCCCC[NH2+][C@H](C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O/c1-3-4-5-10-15-24-16(2)21-25-19-13-8-6-11-17(19)22(27)26(21)20-14-9-7-12-18(20)23/h6-9,11-14,16,24H,3-5,10,15H2,1-2H3/p+1/t16-/m1/s1