methyl 7-(isocyanomethoxy)-3-(3-methylimidazol-4-yl)-6-(trifluoromethyl)naphthalene-1-carboxylate

Systemtic Name: methyl 7-(isocyanomethoxy)-3-(3-methylimidazol-4-yl)-6-(trifluoromethyl)naphthalene-1-carboxylate Openeye Name: methyl 7-(isocyanomethoxy)-3-(3-methylimidazol-4-yl)-6-(trifluoromethyl)naphthalene-1-carboxylate CAS Name: 7-(isocyanomethoxy)-3-(3-methyl-4-imidazolyl)-6-(trifluoromethyl)-1-naphthalenecarboxylic acid methyl ester IUPAC Name: methyl 7-(isocyanomethoxy)-3-(3-methylimidazol-4-yl)-6-(trifluoromethyl)naphthalene-1-carboxylate Traditional Name: 7-(isocyanomethoxy)-3-(3-methylimidazol-4-yl)-6-(trifluoromethyl)naphthalene-1-carboxylic acid methyl ester Formula: C19H14F3N3O3 MolecularWeight: 389.32797

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C2=CC(=C3C=C(C(=CC3=C2)C(F)(F)F)OC[N+]#[C-])C(=O)OC

Isomeric SMILES

CN1C=NC=C1C2=CC(=C3C=C(C(=CC3=C2)C(F)(F)F)OC[N+]#[C-])C(=O)OC

InChI

InChI=1S/C19H14F3N3O3/c1-23-10-28-17-7-13-11(6-15(17)19(20,21)22)4-12(5-14(13)18(26)27-3)16-8-24-9-25(16)2/h4-9H,10H2,2-3H3