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

Systemtic Name: [(1S)-1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)ethyl]-phenethyl-azanium Openeye Name: [(1S)-1-(4-oxo-3-propyl-quinazolin-2-yl)ethyl]-phenethyl-ammonium CAS Name: [(1S)-1-(4-oxo-3-propyl-2-quinazolinyl)ethyl]-phenethylammonium IUPAC Name: [(1S)-1-(4-oxo-3-propylquinazolin-2-yl)ethyl]-phenethylazanium Traditional Name: [(1S)-1-(4-keto-3-propyl-quinazolin-2-yl)ethyl]-phenethyl-ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O/c1-3-15-24-20(23-19-12-8-7-11-18(19)21(24)25)16(2)22-14-13-17-9-5-4-6-10-17/h4-12,16,22H,3,13-15H2,1-2H3/p+1/t16-/m0/s1