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

Systemtic Name: ethyl 3-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O7S/c1-2-32-25(29)18-7-6-8-19(15-18)26-24(28)17-27(35(30,31)21-9-4-3-5-10-21)20-11-12-22-23(16-20)34-14-13-33-22/h3-12,15-16H,2,13-14,17H2,1H3,(H,26,28)