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

Systemtic Name: [(1R)-1-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-hexyl-azanium Openeye Name: [(1R)-1-[3-(2-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-hexyl-ammonium CAS Name: [(1R)-1-[3-(2-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-hexylammonium IUPAC Name: [(1R)-1-[3-(2-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-hexylazanium Traditional Name: hexyl-[(1R)-1-(4-keto-3-o-phenetyl-quinazolin-2-yl)ethyl]ammonium Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OCC

Isomeric SMILES

CCCCCC[NH2+][C@H](C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OCC

InChI

InChI=1S/C24H31N3O2/c1-4-6-7-12-17-25-18(3)23-26-20-14-9-8-13-19(20)24(28)27(23)21-15-10-11-16-22(21)29-5-2/h8-11,13-16,18,25H,4-7,12,17H2,1-3H3/p+1/t18-/m1/s1