4-[(3-chloranyl-4-methoxy-phenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)amino]-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 4-(3-chloro-4-methoxy-anilino)-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-(3-chloro-4-methoxyanilino)-8-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 4-(3-chloro-4-methoxyanilino)-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-(3-chloro-4-methoxy-anilino)-8-(trifluoromethyl)quinoline-3-carboxylate Formula: C18H11ClF3N2O3- MolecularWeight: 395.73975

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C18H12ClF3N2O3/c1-27-14-6-5-9(7-13(14)19)24-15-10-3-2-4-12(18(20,21)22)16(10)23-8-11(15)17(25)26/h2-8H,1H3,(H,23,24)(H,25,26)/p-1