2-[3-(4-chloranylphenoxy)-2-methyl-4-(propan-2-ylsulfonylamino)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(4-chloranylphenoxy)-2-methyl-4-(propan-2-ylsulfonylamino)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(4-chlorophenoxy)-4-(isopropylsulfonylamino)-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-(4-chlorophenoxy)-2-methyl-4-(propan-2-ylsulfonylamino)-1-indolyl]acetic acid IUPAC Name: 2-[3-(4-chlorophenoxy)-2-methyl-4-(propan-2-ylsulfonylamino)indol-1-yl]acetic acid Traditional Name: 2-[3-(4-chlorophenoxy)-4-(isopropylsulfonylamino)-2-methyl-indol-1-yl]acetic acid Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC=C2NS(=O)(=O)C(C)C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC=C2NS(=O)(=O)C(C)C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-12(2)29(26,27)22-16-5-4-6-17-19(16)20(13(3)23(17)11-18(24)25)28-15-9-7-14(21)8-10-15/h4-10,12,22H,11H2,1-3H3,(H,24,25)