prop-2-ynyl 3-[4-(5-fluoranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-3-methyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-ynyl 3-[4-(5-fluoranyl-2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]-3-methyl-pyrrolidine-1-carboxylate Openeye Name: prop-2-ynyl 3-[4-(5-fluoro-2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]-3-methyl-pyrrolidine-1-carboxylate CAS Name: 3-[4-(5-fluoro-2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-3-methyl-1-pyrrolidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 3-[4-(5-fluoro-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-3-methylpyrrolidine-1-carboxylate Traditional Name: 3-[4-(5-fluoro-2-keto-3H-benzimidazol-1-yl)piperidino]-3-methyl-pyrrolidine-1-carboxylic acid propargyl ester Formula: C21H25FN4O3 MolecularWeight: 400.446603

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1)C(=O)OCC#C)N2CCC(CC2)N3C4=C(C=C(C=C4)F)NC3=O

Isomeric SMILES

CC1(CCN(C1)C(=O)OCC#C)N2CCC(CC2)N3C4=C(C=C(C=C4)F)NC3=O

InChI

InChI=1S/C21H25FN4O3/c1-3-12-29-20(28)24-11-8-21(2,14-24)25-9-6-16(7-10-25)26-18-5-4-15(22)13-17(18)23-19(26)27/h1,4-5,13,16H,6-12,14H2,2H3,(H,23,27)