2-[6-chloranyl-1-(4-cyanophenyl)carbonyl-2-methyl-5-oxidanyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-1-(4-cyanophenyl)carbonyl-2-methyl-5-oxidanyl-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-1-(4-cyanobenzoyl)-5-hydroxy-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[6-chloro-1-[(4-cyanophenyl)-oxomethyl]-5-hydroxy-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[6-chloro-1-(4-cyanobenzoyl)-5-hydroxy-2-methylindol-3-yl]acetic acid Traditional Name: 2-[6-chloro-1-(4-cyanobenzoyl)-5-hydroxy-2-methyl-indol-3-yl]acetic acid Formula: C19H13ClN2O4 MolecularWeight: 368.77052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1C(=O)C3=CC=C(C=C3)C#N)Cl)O)CC(=O)O

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1C(=O)C3=CC=C(C=C3)C#N)Cl)O)CC(=O)O

InChI

InChI=1S/C19H13ClN2O4/c1-10-13(7-18(24)25)14-6-17(23)15(20)8-16(14)22(10)19(26)12-4-2-11(9-21)3-5-12/h2-6,8,23H,7H2,1H3,(H,24,25)