2-[3-[(4-chlorophenyl)-oxidanyl-methyl]-2-methyl-6-oxidanyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(4-chlorophenyl)-oxidanyl-methyl]-2-methyl-6-oxidanyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-[(4-chlorophenyl)-hydroxy-methyl]-6-hydroxy-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-[(4-chlorophenyl)-hydroxymethyl]-6-hydroxy-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-[(4-chlorophenyl)-hydroxymethyl]-6-hydroxy-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-[(4-chlorophenyl)-hydroxy-methyl]-6-hydroxy-2-methyl-indol-1-yl]acetic acid Formula: C18H16ClNO4 MolecularWeight: 345.77694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=C(C=C2)O)C(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=C(C=C2)O)C(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C18H16ClNO4/c1-10-17(18(24)11-2-4-12(19)5-3-11)14-7-6-13(21)8-15(14)20(10)9-16(22)23/h2-8,18,21,24H,9H2,1H3,(H,22,23)