methyl 4-[1-(3-propan-2-ylphenyl)sulfonyl-5-(trifluoromethyl)indol-2-yl]butanoate

Systemtic Name: methyl 4-[1-(3-propan-2-ylphenyl)sulfonyl-5-(trifluoromethyl)indol-2-yl]butanoate Openeye Name: methyl 4-[1-(3-isopropylphenyl)sulfonyl-5-(trifluoromethyl)indol-2-yl]butanoate CAS Name: 4-[1-(3-propan-2-ylphenyl)sulfonyl-5-(trifluoromethyl)-2-indolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[1-(3-propan-2-ylphenyl)sulfonyl-5-(trifluoromethyl)indol-2-yl]butanoate Traditional Name: 4-[1-m-cumenylsulfonyl-5-(trifluoromethyl)indol-2-yl]butyric acid methyl ester Formula: C23H24F3NO4S MolecularWeight: 467.50117

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)S(=O)(=O)N2C3=C(C=C(C=C3)C(F)(F)F)C=C2CCCC(=O)OC

Isomeric SMILES

CC(C)C1=CC(=CC=C1)S(=O)(=O)N2C3=C(C=C(C=C3)C(F)(F)F)C=C2CCCC(=O)OC

InChI

InChI=1S/C23H24F3NO4S/c1-15(2)16-6-4-8-20(14-16)32(29,30)27-19(7-5-9-22(28)31-3)13-17-12-18(23(24,25)26)10-11-21(17)27/h4,6,8,10-15H,5,7,9H2,1-3H3