methyl (2E,4E)-6-[2-iodanylprop-2-enyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-hexa-2,4-dienoate

Systemtic Name: methyl (2E,4E)-6-[2-iodanylprop-2-enyl-(4-methylphenyl)sulfonyl-amino]-3-phenyl-hexa-2,4-dienoate Openeye Name: methyl (2E,4E)-6-[2-iodoallyl(p-tolylsulfonyl)amino]-3-phenyl-hexa-2,4-dienoate CAS Name: (2E,4E)-6-[2-iodoprop-2-enyl-(4-methylphenyl)sulfonylamino]-3-phenylhexa-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E,4E)-6-[2-iodoprop-2-enyl-(4-methylphenyl)sulfonylamino]-3-phenylhexa-2,4-dienoate Traditional Name: (2E,4E)-6-[2-iodoallyl(tosyl)amino]-3-phenyl-hexa-2,4-dienoic acid methyl ester Formula: C23H24INO4S MolecularWeight: 537.41043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=CC(=CC(=O)OC)C2=CC=CC=C2)CC(=C)I

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C/C=C/C(=C\C(=O)OC)/C2=CC=CC=C2)CC(=C)I

InChI

InChI=1S/C23H24INO4S/c1-18-11-13-22(14-12-18)30(27,28)25(17-19(2)24)15-7-10-21(16-23(26)29-3)20-8-5-4-6-9-20/h4-14,16H,2,15,17H2,1,3H3/b10-7+,21-16+