[(1R)-1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-butyl-azanium

Systemtic Name: [(1R)-1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-butyl-azanium Openeye Name: [(1R)-1-[3-(4-bromophenyl)-4-oxo-quinazolin-2-yl]ethyl]-butyl-ammonium CAS Name: [(1R)-1-[3-(4-bromophenyl)-4-oxo-2-quinazolinyl]ethyl]-butylammonium IUPAC Name: [(1R)-1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]ethyl]-butylazanium Traditional Name: [(1R)-1-[3-(4-bromophenyl)-4-keto-quinazolin-2-yl]ethyl]-butyl-ammonium Formula: C20H23BrN3O+ MolecularWeight: 401.32012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O/c1-3-4-13-22-14(2)19-23-18-8-6-5-7-17(18)20(25)24(19)16-11-9-15(21)10-12-16/h5-12,14,22H,3-4,13H2,1-2H3/p+1/t14-/m1/s1