3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)-1-phenyl-butan-1-one

Systemtic Name: 3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)-1-phenyl-butan-1-one Openeye Name: 3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)-1-phenyl-butan-1-one CAS Name: 3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-5-isoxazolyl)-1-phenyl-1-butanone IUPAC Name: 3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)-1-phenylbutan-1-one Traditional Name: 3-(2,4-dichlorophenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)-1-phenyl-butan-1-one Formula: C20H16Cl2N2O4 MolecularWeight: 419.25804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])CC(CC(=O)C2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])CC(CC(=O)C2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H16Cl2N2O4/c1-12-20(24(26)27)19(28-23-12)10-14(16-8-7-15(21)11-17(16)22)9-18(25)13-5-3-2-4-6-13/h2-8,11,14H,9-10H2,1H3