methyl 4,5-dimethoxy-2-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[2-[methylsulfonyl-(4-propoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[2-(N-methylsulfonyl-4-propoxy-anilino)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[2-(N-methylsulfonyl-4-propoxyanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[2-(N-methylsulfonyl-4-propoxyanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(N-mesyl-4-propoxy-anilino)acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H28N2O8S MolecularWeight: 480.53132

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N(CC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)S(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N(CC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O8S/c1-6-11-32-16-9-7-15(8-10-16)24(33(5,27)28)14-21(25)23-18-13-20(30-3)19(29-2)12-17(18)22(26)31-4/h7-10,12-13H,6,11,14H2,1-5H3,(H,23,25)