methyl 2-[2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]ethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]ethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-[1,3-benzodioxol-5-yl(esyl)amino]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H24N2O9S MolecularWeight: 480.48826

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H24N2O9S/c1-5-33(26,27)23(13-6-7-16-19(8-13)32-12-31-16)11-20(24)22-15-10-18(29-3)17(28-2)9-14(15)21(25)30-4/h6-10H,5,11-12H2,1-4H3,(H,22,24)