2-[(2S)-2-(4-chlorophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[(2S)-2-(4-chlorophenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]ethyl-diethyl-azanium Openeye Name: 2-[(2S)-2-(4-chlorophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]ethyl-diethyl-ammonium CAS Name: 2-[(2S)-2-(4-chlorophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]ethyl-diethylammonium IUPAC Name: 2-[(2S)-2-(4-chlorophenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]ethyl-diethylazanium Traditional Name: 2-[(2S)-2-(4-chlorophenyl)-4-keto-1,2-dihydroquinazolin-3-yl]ethyl-diethyl-ammonium Formula: C20H25ClN3O+ MolecularWeight: 358.885

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(NC2=CC=CC=C2C1=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+](CC)CCN1[C@H](NC2=CC=CC=C2C1=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O/c1-3-23(4-2)13-14-24-19(15-9-11-16(21)12-10-15)22-18-8-6-5-7-17(18)20(24)25/h5-12,19,22H,3-4,13-14H2,1-2H3/p+1/t19-/m0/s1