methyl 3-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]benzoate CAS Name: 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]benzoate Traditional Name: 3-[[2-[besyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]benzoic acid methyl ester Formula: C24H22N2O7S MolecularWeight: 482.50568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O7S/c1-31-24(28)17-6-5-7-18(14-17)25-23(27)16-26(34(29,30)20-8-3-2-4-9-20)19-10-11-21-22(15-19)33-13-12-32-21/h2-11,14-15H,12-13,16H2,1H3,(H,25,27)