5-[[3,4-bis(trifluoromethyl)phenyl]methoxy]-6-methoxy-1H-indole-2-carboxylic acid

Systemtic Name: 5-[[3,4-bis(trifluoromethyl)phenyl]methoxy]-6-methoxy-1H-indole-2-carboxylic acid Openeye Name: 5-[[3,4-bis(trifluoromethyl)phenyl]methoxy]-6-methoxy-1H-indole-2-carboxylic acid CAS Name: 5-[[3,4-bis(trifluoromethyl)phenyl]methoxy]-6-methoxy-1H-indole-2-carboxylic acid IUPAC Name: 5-[[3,4-bis(trifluoromethyl)phenyl]methoxy]-6-methoxy-1H-indole-2-carboxylic acid Traditional Name: 5-[3,4-bis(trifluoromethyl)benzyl]oxy-6-methoxy-1H-indole-2-carboxylic acid Formula: C19H13F6NO4 MolecularWeight: 433.301239

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(NC2=C1)C(=O)O)OCC3=CC(=C(C=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=C(C=C2C=C(NC2=C1)C(=O)O)OCC3=CC(=C(C=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H13F6NO4/c1-29-15-7-13-10(5-14(26-13)17(27)28)6-16(15)30-8-9-2-3-11(18(20,21)22)12(4-9)19(23,24)25/h2-7,26H,8H2,1H3,(H,27,28)