dimethyl 4-[methanoyl-[(E)-1-(4-methylphenyl)sulfonylpent-1-en-2-yl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 4-[methanoyl-[(E)-1-(4-methylphenyl)sulfonylpent-1-en-2-yl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 4-[formyl-[(1E)-1-(p-tolylsulfonylmethylene)butyl]amino]benzene-1,3-dicarboxylate CAS Name: 4-[formyl-[(E)-1-(4-methylphenyl)sulfonylpent-1-en-2-yl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-[formyl-[(E)-1-(4-methylphenyl)sulfonylpent-1-en-2-yl]amino]benzene-1,3-dicarboxylate Traditional Name: 4-[formyl-[(E)-1-propyl-2-tosyl-vinyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H25NO7S MolecularWeight: 459.5121

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=CS(=O)(=O)C1=CC=C(C=C1)C)N(C=O)C2=C(C=C(C=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCC/C(=C\S(=O)(=O)C1=CC=C(C=C1)C)/N(C=O)C2=C(C=C(C=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C23H25NO7S/c1-5-6-18(14-32(28,29)19-10-7-16(2)8-11-19)24(15-25)21-12-9-17(22(26)30-3)13-20(21)23(27)31-4/h7-15H,5-6H2,1-4H3/b18-14+