2-[3-(4-chloranylphenoxy)-2-methyl-5-(methylsulfonylamino)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-chloranylphenoxy)-2-methyl-5-(methylsulfonylamino)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(4-chlorophenoxy)-5-(methanesulfonamido)-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-(4-chlorophenoxy)-5-(methanesulfonamido)-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(4-chlorophenoxy)-5-(methanesulfonamido)-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-(4-chlorophenoxy)-5-(methanesulfonamido)-2-methyl-indol-1-yl]acetic acid Formula: C18H17ClN2O5S MolecularWeight: 408.85598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)NS(=O)(=O)C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)NS(=O)(=O)C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O5S/c1-11-18(26-14-6-3-12(19)4-7-14)15-9-13(20-27(2,24)25)5-8-16(15)21(11)10-17(22)23/h3-9,20H,10H2,1-2H3,(H,22,23)