methyl 2-[2-[ethyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-[ethyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-[ethyl(p-tolylsulfonyl)amino]acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-[ethyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-[ethyl-(4-methylphenyl)sulfonylamino]acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-[ethyl(tosyl)amino]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC(=O)NC1=CC(=C(C=C1C(=O)OC)OC)OC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H26N2O7S/c1-6-23(31(26,27)15-9-7-14(2)8-10-15)13-20(24)22-17-12-19(29-4)18(28-3)11-16(17)21(25)30-5/h7-12H,6,13H2,1-5H3,(H,22,24)