methyl 3-[3-(4-chlorophenyl)carbonyl-1-methyl-6-oxidanyl-indol-2-yl]-2,2-dimethyl-propanoate

Systemtic Name: methyl 3-[3-(4-chlorophenyl)carbonyl-1-methyl-6-oxidanyl-indol-2-yl]-2,2-dimethyl-propanoate Openeye Name: methyl 3-[3-(4-chlorobenzoyl)-6-hydroxy-1-methyl-indol-2-yl]-2,2-dimethyl-propanoate CAS Name: 3-[3-[(4-chlorophenyl)-oxomethyl]-6-hydroxy-1-methyl-2-indolyl]-2,2-dimethylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-chlorobenzoyl)-6-hydroxy-1-methylindol-2-yl]-2,2-dimethylpropanoate Traditional Name: 3-[3-(4-chlorobenzoyl)-6-hydroxy-1-methyl-indol-2-yl]-2,2-dimethyl-propionic acid methyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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