methyl 4-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]-3-prop-2-enylsulfonyl-butanoate

Systemtic Name: methyl 4-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]-3-prop-2-enylsulfonyl-butanoate Openeye Name: methyl 4-[allyl(p-tolylsulfonyl)amino]-3-allylsulfonyl-butanoate CAS Name: 4-[(4-methylphenyl)sulfonyl-prop-2-enylamino]-3-prop-2-enylsulfonylbutanoic acid methyl ester IUPAC Name: methyl 4-[(4-methylphenyl)sulfonyl-prop-2-enylamino]-3-prop-2-enylsulfonylbutanoate Traditional Name: 3-allylsulfonyl-4-[allyl(tosyl)amino]butyric acid methyl ester Formula: C18H25NO6S2 MolecularWeight: 415.5242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO6S2/c1-5-11-19(27(23,24)16-9-7-15(3)8-10-16)14-17(13-18(20)25-4)26(21,22)12-6-2/h5-10,17H,1-2,11-14H2,3-4H3