[(1R)-1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-hexyl-azanium

Systemtic Name: [(1R)-1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-hexyl-azanium Openeye Name: [(1R)-1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-hexyl-ammonium CAS Name: [(1R)-1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-hexylammonium IUPAC Name: [(1R)-1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]-hexylazanium Traditional Name: [(1R)-1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]-hexyl-ammonium Formula: C25H34N3O+ MolecularWeight: 392.55696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O/c1-4-7-8-11-18-26-22(6-3)24-27-23-13-10-9-12-21(23)25(29)28(24)20-16-14-19(5-2)15-17-20/h9-10,12-17,22,26H,4-8,11,18H2,1-3H3/p+1/t22-/m1/s1