(E,4R,5R)-1-(4-dimethylaminophenyl)-4-methyl-5-(4-nitrophenyl)-5-oxidanyl-pent-1-en-3-one

Systemtic Name: (E,4R,5R)-1-(4-dimethylaminophenyl)-4-methyl-5-(4-nitrophenyl)-5-oxidanyl-pent-1-en-3-one Openeye Name: (E,4R,5R)-1-(4-dimethylaminophenyl)-5-hydroxy-4-methyl-5-(4-nitrophenyl)pent-1-en-3-one CAS Name: (E,4R,5R)-1-(4-dimethylaminophenyl)-5-hydroxy-4-methyl-5-(4-nitrophenyl)-1-penten-3-one IUPAC Name: (E,4R,5R)-1-(4-dimethylaminophenyl)-5-hydroxy-4-methyl-5-(4-nitrophenyl)pent-1-en-3-one Traditional Name: (E,4R,5R)-1-(4-dimethylaminophenyl)-5-hydroxy-4-methyl-5-(4-nitrophenyl)pent-1-en-3-one Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)C(=O)C=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H]([C@H](C1=CC=C(C=C1)[N+](=O)[O-])O)C(=O)/C=C/C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H22N2O4/c1-14(20(24)16-7-11-18(12-8-16)22(25)26)19(23)13-6-15-4-9-17(10-5-15)21(2)3/h4-14,20,24H,1-3H3/b13-6+/t14-,20+/m0/s1