[2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate

Systemtic Name: [2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanylidene-ethyl] 5-methylpyrazine-2-carboxylate Openeye Name: [2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxo-ethyl] 5-methylpyrazine-2-carboxylate CAS Name: 5-methyl-2-pyrazinecarboxylic acid [2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxoethyl] 5-methylpyrazine-2-carboxylate Traditional Name: 5-methylpyrazinic acid [2-[cyclopropyl-(2-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H18FN3O3 MolecularWeight: 343.352223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)OCC(=O)N(CC2=CC=CC=C2F)C3CC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)OCC(=O)N(CC2=CC=CC=C2F)C3CC3

InChI

InChI=1S/C18H18FN3O3/c1-12-8-21-16(9-20-12)18(24)25-11-17(23)22(14-6-7-14)10-13-4-2-3-5-15(13)19/h2-5,8-9,14H,6-7,10-11H2,1H3