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

Systemtic Name: but-2-ynyl 3-methyl-3-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]pyrrolidine-1-carboxylate Openeye Name: but-2-ynyl 3-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]pyrrolidine-1-carboxylate CAS Name: 3-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]-1-pyrrolidinecarboxylic acid but-2-ynyl ester IUPAC Name: but-2-ynyl 3-methyl-3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]pyrrolidine-1-carboxylate Traditional Name: 3-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]-3-methyl-pyrrolidine-1-carboxylic acid but-2-ynyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC(=O)N1CCC(C1)(C)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC#CCOC(=O)N1CCC(C1)(C)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H28N4O3/c1-3-4-15-29-21(28)24-14-11-22(2,16-24)25-12-9-17(10-13-25)26-19-8-6-5-7-18(19)23-20(26)27/h5-8,17H,9-16H2,1-2H3,(H,23,27)