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

Systemtic Name: ethyl 3-[2-[2,3-dihydro-1,4-benzodioxin-6-yl(phenylsulfonyl)amino]ethanoylamino]-2-methyl-benzoate Openeye Name: ethyl 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]-2-methyl-benzoate CAS Name: 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxoethyl]amino]-2-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[benzenesulfonyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]-2-methylbenzoate Traditional Name: 3-[[2-[besyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]acetyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C26H26N2O7S MolecularWeight: 510.55884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O7S/c1-3-33-26(30)21-10-7-11-22(18(21)2)27-25(29)17-28(36(31,32)20-8-5-4-6-9-20)19-12-13-23-24(16-19)35-15-14-34-23/h4-13,16H,3,14-15,17H2,1-2H3,(H,27,29)