methyl 3-[(2R)-1-[(2-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzotriazole-5-carboxylate

Systemtic Name: methyl 3-[(2R)-1-[(2-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzotriazole-5-carboxylate Openeye Name: methyl 3-[(1R)-2-(2-chloro-4-fluoro-anilino)-1-methyl-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[(2R)-1-(2-chloro-4-fluoroanilino)-1-oxopropan-2-yl]oxy-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2R)-1-(2-chloro-4-fluoroanilino)-1-oxopropan-2-yl]oxybenzotriazole-5-carboxylate Traditional Name: 3-[(1R)-2-(2-chloro-4-fluoro-anilino)-2-keto-1-methyl-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C17H14ClFN4O4 MolecularWeight: 392.768863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)ON2C3=C(C=CC(=C3)C(=O)OC)N=N2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)F)Cl)ON2C3=C(C=CC(=C3)C(=O)OC)N=N2

InChI

InChI=1S/C17H14ClFN4O4/c1-9(16(24)20-13-6-4-11(19)8-12(13)18)27-23-15-7-10(17(25)26-2)3-5-14(15)21-22-23/h3-9H,1-2H3,(H,20,24)/t9-/m1/s1