(E)-3-(3-nitrophenyl)-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-nitrophenyl)-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-(3-nitrophenyl)-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-nitrophenyl)-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-nitrophenyl)-1-(4-p-cumenylsulfonylpiperazino)prop-2-en-1-one Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O5S/c1-17(2)19-7-9-21(10-8-19)31(29,30)24-14-12-23(13-15-24)22(26)11-6-18-4-3-5-20(16-18)25(27)28/h3-11,16-17H,12-15H2,1-2H3/b11-6+