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

Systemtic Name: (3R)-1-(4-tert-butylphenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)-3-phenyl-butan-1-one Openeye Name: (3R)-1-(4-tert-butylphenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)-3-phenyl-butan-1-one CAS Name: (3R)-1-(4-tert-butylphenyl)-4-(3-methyl-4-nitro-5-isoxazolyl)-3-phenyl-1-butanone IUPAC Name: (3R)-1-(4-tert-butylphenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)-3-phenylbutan-1-one Traditional Name: (3R)-1-(4-tert-butylphenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)-3-phenyl-butan-1-one Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O4/c1-16-23(26(28)29)22(30-25-16)15-19(17-8-6-5-7-9-17)14-21(27)18-10-12-20(13-11-18)24(2,3)4/h5-13,19H,14-15H2,1-4H3/t19-/m0/s1