methyl 4-[2-[prop-2-enyl-(2,4,6-trimethylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[prop-2-enyl-(2,4,6-trimethylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[allyl-(2,4,6-trimethylphenyl)sulfonyl-amino]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[prop-2-enyl-(2,4,6-trimethylphenyl)sulfonylamino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[prop-2-enyl-(2,4,6-trimethylphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[allyl(mesitylsulfonyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC=C)CC(=O)NC2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CC=C)CC(=O)NC2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C22H26N2O5S/c1-6-11-24(30(27,28)21-16(3)12-15(2)13-17(21)4)14-20(25)23-19-9-7-18(8-10-19)22(26)29-5/h6-10,12-13H,1,11,14H2,2-5H3,(H,23,25)