2-(3-azanyl-5-oxidanylidene-4H-1,2-oxazol-4-yl)-1-(4-chlorophenyl)-4-(4-methylphenyl)butane-1,4-dione

Systemtic Name: 2-(3-azanyl-5-oxidanylidene-4H-1,2-oxazol-4-yl)-1-(4-chlorophenyl)-4-(4-methylphenyl)butane-1,4-dione Openeye Name: 2-(3-amino-5-oxo-4H-isoxazol-4-yl)-1-(4-chlorophenyl)-4-(p-tolyl)butane-1,4-dione CAS Name: 2-(3-amino-5-oxo-4H-isoxazol-4-yl)-1-(4-chlorophenyl)-4-(4-methylphenyl)butane-1,4-dione IUPAC Name: 2-(3-amino-5-oxo-4H-1,2-oxazol-4-yl)-1-(4-chlorophenyl)-4-(4-methylphenyl)butane-1,4-dione Traditional Name: 2-(3-amino-5-keto-2-isoxazolin-4-yl)-1-(4-chlorophenyl)-4-(p-tolyl)butane-1,4-dione Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C2C(=NOC2=O)N)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CC(C2C(=NOC2=O)N)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H17ClN2O4/c1-11-2-4-12(5-3-11)16(24)10-15(17-19(22)23-27-20(17)26)18(25)13-6-8-14(21)9-7-13/h2-9,15,17H,10H2,1H3,(H2,22,23)