methyl 4-[3-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]benzoate

Systemtic Name: methyl 4-[3-[(1-ethanoyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]benzoate Openeye Name: methyl 4-[3-(1-acetylindolin-5-yl)sulfonylpropanoylamino]benzoate CAS Name: 4-[[3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[(1-acetyl-2,3-dihydroindol-5-yl)sulfonyl]propanoylamino]benzoate Traditional Name: 4-[3-(1-acetylindolin-5-yl)sulfonylpropanoylamino]benzoic acid methyl ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)CCC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O6S/c1-14(24)23-11-9-16-13-18(7-8-19(16)23)30(27,28)12-10-20(25)22-17-5-3-15(4-6-17)21(26)29-2/h3-8,13H,9-12H2,1-2H3,(H,22,25)