methyl 4-methyl-3-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[methyl-[(E)-2-phenylethenyl]sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[methyl-[(E)-styryl]sulfonyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5S/c1-15-9-10-17(20(24)27-3)13-18(15)21-19(23)14-22(2)28(25,26)12-11-16-7-5-4-6-8-16/h4-13H,14H2,1-3H3,(H,21,23)/b12-11+