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

Systemtic Name: methyl 4-[5-chloranyl-1-(3-propan-2-ylphenyl)sulfonyl-indol-2-yl]butanoate Openeye Name: methyl 4-[5-chloro-1-(3-isopropylphenyl)sulfonyl-indol-2-yl]butanoate CAS Name: 4-[5-chloro-1-(3-propan-2-ylphenyl)sulfonyl-2-indolyl]butanoic acid methyl ester IUPAC Name: methyl 4-[5-chloro-1-(3-propan-2-ylphenyl)sulfonylindol-2-yl]butanoate Traditional Name: 4-(5-chloro-1-m-cumenylsulfonyl-indol-2-yl)butyric acid methyl ester Formula: C22H24ClNO4S MolecularWeight: 433.94826

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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)Cl)C=C2CCCC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClNO4S/c1-15(2)16-6-4-8-20(14-16)29(26,27)24-19(7-5-9-22(25)28-3)13-17-12-18(23)10-11-21(17)24/h4,6,8,10-15H,5,7,9H2,1-3H3