2-(2-methoxy-4-prop-2-enyl-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-methoxy-4-prop-2-enyl-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C22H25N3O7S MolecularWeight: 475.5148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O7S/c1-3-5-17-8-9-20(21(14-17)31-2)32-16-22(26)23-10-12-24(13-11-23)33(29,30)19-7-4-6-18(15-19)25(27)28/h3-4,6-9,14-15H,1,5,10-13,16H2,2H3