[(1S)-1-(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-phenethyl-azanium

Systemtic Name: [(1S)-1-(7-chloranyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-phenethyl-azanium Openeye Name: [(1S)-1-(7-chloro-3-ethyl-4-oxo-quinazolin-2-yl)ethyl]-phenethyl-ammonium CAS Name: [(1S)-1-(7-chloro-3-ethyl-4-oxo-2-quinazolinyl)ethyl]-phenethylammonium IUPAC Name: [(1S)-1-(7-chloro-3-ethyl-4-oxoquinazolin-2-yl)ethyl]-phenethylazanium Traditional Name: [(1S)-1-(7-chloro-3-ethyl-4-keto-quinazolin-2-yl)ethyl]-phenethyl-ammonium Formula: C20H23ClN3O+ MolecularWeight: 356.86912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1C(C)[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1[C@H](C)[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C20H22ClN3O/c1-3-24-19(14(2)22-12-11-15-7-5-4-6-8-15)23-18-13-16(21)9-10-17(18)20(24)25/h4-10,13-14,22H,3,11-12H2,1-2H3/p+1/t14-/m0/s1