methyl 1-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-6-(trifluoromethyl)indole-3-carboxylate

Systemtic Name: methyl 1-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-6-(trifluoromethyl)indole-3-carboxylate Openeye Name: methyl 1-[(E)-3-methoxy-3-oxo-prop-1-enyl]-6-(trifluoromethyl)indole-3-carboxylate CAS Name: 1-[(E)-3-methoxy-3-oxoprop-1-enyl]-6-(trifluoromethyl)-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(E)-3-methoxy-3-oxoprop-1-enyl]-6-(trifluoromethyl)indole-3-carboxylate Traditional Name: 1-[(E)-3-keto-3-methoxy-prop-1-enyl]-6-(trifluoromethyl)indole-3-carboxylic acid methyl ester Formula: C15H12F3NO4 MolecularWeight: 327.25529

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CN1C=C(C2=C1C=C(C=C2)C(F)(F)F)C(=O)OC

Isomeric SMILES

COC(=O)/C=C/N1C=C(C2=C1C=C(C=C2)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C15H12F3NO4/c1-22-13(20)5-6-19-8-11(14(21)23-2)10-4-3-9(7-12(10)19)15(16,17)18/h3-8H,1-2H3/b6-5+