pentan-3-yl 6-(2-azanylethanoylcarbamoyloxy)-5-[(4-fluorophenyl)methoxy]pyridine-3-carboxylate

Systemtic Name: pentan-3-yl 6-(2-azanylethanoylcarbamoyloxy)-5-[(4-fluorophenyl)methoxy]pyridine-3-carboxylate Openeye Name: 1-ethylpropyl 6-[(2-aminoacetyl)carbamoyloxy]-5-[(4-fluorophenyl)methoxy]pyridine-3-carboxylate CAS Name: 6-[[(2-amino-1-oxoethyl)amino]-oxomethoxy]-5-[(4-fluorophenyl)methoxy]-3-pyridinecarboxylic acid pentan-3-yl ester IUPAC Name: pentan-3-yl 6-[(2-aminoacetyl)carbamoyloxy]-5-[(4-fluorophenyl)methoxy]pyridine-3-carboxylate Traditional Name: 5-(4-fluorobenzyl)oxy-6-(glycylcarbamoyloxy)nicotinic acid 1-ethylpropyl ester Formula: C21H24FN3O6 MolecularWeight: 433.430163

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC(=O)C1=CC(=C(N=C1)OC(=O)NC(=O)CN)OCC2=CC=C(C=C2)F

Isomeric SMILES

CCC(CC)OC(=O)C1=CC(=C(N=C1)OC(=O)NC(=O)CN)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FN3O6/c1-3-16(4-2)30-20(27)14-9-17(29-12-13-5-7-15(22)8-6-13)19(24-11-14)31-21(28)25-18(26)10-23/h5-9,11,16H,3-4,10,12,23H2,1-2H3,(H,25,26,28)