tert-butyl 2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-oxidanyl-indol-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-oxidanyl-indol-3-yl]ethanoate Openeye Name: tert-butyl 2-[1-(4-chlorobenzoyl)-5-hydroxy-2-methyl-indol-3-yl]acetate CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-hydroxy-2-methyl-3-indolyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(4-chlorobenzoyl)-5-hydroxy-2-methylindol-3-yl]acetate Traditional Name: 2-[1-(4-chlorobenzoyl)-5-hydroxy-2-methyl-indol-3-yl]acetic acid tert-butyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)O)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C22H22ClNO4/c1-13-17(12-20(26)28-22(2,3)4)18-11-16(25)9-10-19(18)24(13)21(27)14-5-7-15(23)8-6-14/h5-11,25H,12H2,1-4H3