[(1S)-1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)propyl]-phenethyl-azanium

Systemtic Name: [(1S)-1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)propyl]-phenethyl-azanium Openeye Name: [(1S)-1-(4-oxo-3-propyl-quinazolin-2-yl)propyl]-phenethyl-ammonium CAS Name: [(1S)-1-(4-oxo-3-propyl-2-quinazolinyl)propyl]-phenethylammonium IUPAC Name: [(1S)-1-(4-oxo-3-propylquinazolin-2-yl)propyl]-phenethylazanium Traditional Name: [(1S)-1-(4-keto-3-propyl-quinazolin-2-yl)propyl]-phenethyl-ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1C(CC)[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1[C@H](CC)[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O/c1-3-16-25-21(24-20-13-9-8-12-18(20)22(25)26)19(4-2)23-15-14-17-10-6-5-7-11-17/h5-13,19,23H,3-4,14-16H2,1-2H3/p+1/t19-/m0/s1