butyl 4-[2-[3-(4-fluorophenyl)sulfonylindol-1-yl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[3-(4-fluorophenyl)sulfonylindol-1-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-(4-fluorophenyl)sulfonyl-1-indolyl]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-(4-fluorophenyl)sulfonylindol-1-yl]acetyl]amino]benzoic acid butyl ester Formula: C27H25FN2O5S MolecularWeight: 508.561203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H25FN2O5S/c1-2-3-16-35-27(32)19-8-12-21(13-9-19)29-26(31)18-30-17-25(23-6-4-5-7-24(23)30)36(33,34)22-14-10-20(28)11-15-22/h4-15,17H,2-3,16,18H2,1H3,(H,29,31)