ethyl 6-(3-acetamidopyrrolidin-1-yl)-2-[cyclopropyl-(3-ethoxy-3-oxidanylidene-propyl)amino]-5-fluoranyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-(3-acetamidopyrrolidin-1-yl)-2-[cyclopropyl-(3-ethoxy-3-oxidanylidene-propyl)amino]-5-fluoranyl-pyridine-3-carboxylate Openeye Name: ethyl 6-(3-acetamidopyrrolidin-1-yl)-2-[cyclopropyl-(3-ethoxy-3-oxo-propyl)amino]-5-fluoro-pyridine-3-carboxylate CAS Name: 6-(3-acetamido-1-pyrrolidinyl)-2-[cyclopropyl-(3-ethoxy-3-oxopropyl)amino]-5-fluoro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-acetamidopyrrolidin-1-yl)-2-[cyclopropyl-(3-ethoxy-3-oxopropyl)amino]-5-fluoropyridine-3-carboxylate Traditional Name: 6-(3-acetamidopyrrolidino)-2-[cyclopropyl-(3-ethoxy-3-keto-propyl)amino]-5-fluoro-nicotinic acid ethyl ester Formula: C22H31FN4O5 MolecularWeight: 450.503743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1CC1)C2=NC(=C(C=C2C(=O)OCC)F)N3CCC(C3)NC(=O)C

Isomeric SMILES

CCOC(=O)CCN(C1CC1)C2=NC(=C(C=C2C(=O)OCC)F)N3CCC(C3)NC(=O)C

InChI

InChI=1S/C22H31FN4O5/c1-4-31-19(29)9-11-27(16-6-7-16)20-17(22(30)32-5-2)12-18(23)21(25-20)26-10-8-15(13-26)24-14(3)28/h12,15-16H,4-11,13H2,1-3H3,(H,24,28)