carbamimidoyl 2-[2-aminocarbonyl-1-methyl-4-(trifluoromethyl)indol-6-yl]-2-oxidanylidene-ethanoate

Systemtic Name: carbamimidoyl 2-[2-aminocarbonyl-1-methyl-4-(trifluoromethyl)indol-6-yl]-2-oxidanylidene-ethanoate Openeye Name: carbamimidoyl 2-[2-carbamoyl-1-methyl-4-(trifluoromethyl)indol-6-yl]-2-oxo-acetate CAS Name: 2-[2-carbamoyl-1-methyl-4-(trifluoromethyl)-6-indolyl]-2-oxoacetic acid carbamimidoyl ester IUPAC Name: carbamimidoyl 2-[2-carbamoyl-1-methyl-4-(trifluoromethyl)indol-6-yl]-2-oxoacetate Traditional Name: 2-[2-carbamoyl-1-methyl-4-(trifluoromethyl)indol-6-yl]-2-keto-acetic acid amidino ester Formula: C14H11F3N4O4 MolecularWeight: 356.25675

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=CC(=C2C=C1C(=O)N)C(F)(F)F)C(=O)C(=O)OC(=N)N

Isomeric SMILES

CN1C2=CC(=CC(=C2C=C1C(=O)N)C(F)(F)F)C(=O)C(=O)OC(=N)N

InChI

InChI=1S/C14H11F3N4O4/c1-21-8-3-5(10(22)12(24)25-13(19)20)2-7(14(15,16)17)6(8)4-9(21)11(18)23/h2-4H,1H3,(H2,18,23)(H3,19,20)