(1E)-1-[1-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)azetidin-2-ylidene]propan-2-one

Systemtic Name: (1E)-1-[1-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)azetidin-2-ylidene]propan-2-one Openeye Name: (1E)-1-[4-(3-nitrophenyl)-1-(p-tolylsulfonyl)azetidin-2-ylidene]propan-2-one CAS Name: (1E)-1-[1-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-2-azetidinylidene]-2-propanone IUPAC Name: (1E)-1-[1-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)azetidin-2-ylidene]propan-2-one Traditional Name: (1E)-1-[4-(3-nitrophenyl)-1-tosyl-azetidin-2-ylidene]acetone Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC2=CC(=O)C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N\2C(C/C2=C\C(=O)C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5S/c1-13-6-8-18(9-7-13)27(25,26)20-17(10-14(2)22)12-19(20)15-4-3-5-16(11-15)21(23)24/h3-11,19H,12H2,1-2H3/b17-10+