3-[(4-methoxyphenyl)methylamino]-5-(trifluoromethyl)quinoxaline-2-carboxylic acid

Systemtic Name: 3-[(4-methoxyphenyl)methylamino]-5-(trifluoromethyl)quinoxaline-2-carboxylic acid Openeye Name: 3-[(4-methoxyphenyl)methylamino]-5-(trifluoromethyl)quinoxaline-2-carboxylic acid CAS Name: 3-[(4-methoxyphenyl)methylamino]-5-(trifluoromethyl)-2-quinoxalinecarboxylic acid IUPAC Name: 3-[(4-methoxyphenyl)methylamino]-5-(trifluoromethyl)quinoxaline-2-carboxylic acid Traditional Name: 3-(p-anisylamino)-5-(trifluoromethyl)quinoxaline-2-carboxylic acid Formula: C18H14F3N3O3 MolecularWeight: 377.31727

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC3=C(C=CC=C3N=C2C(=O)O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC3=C(C=CC=C3N=C2C(=O)O)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O3/c1-27-11-7-5-10(6-8-11)9-22-16-15(17(25)26)23-13-4-2-3-12(14(13)24-16)18(19,20)21/h2-8H,9H2,1H3,(H,22,24)(H,25,26)