tert-butyl 4-[1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(2-methoxy-5-methyl-phenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2-methoxy-5-methylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-keto-1-(2-methoxy-5-methyl-phenyl)pyrrolidine-3-carbonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2CC(CC2=O)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H31N3O5/c1-15-6-7-18(29-5)17(12-15)25-14-16(13-19(25)26)20(27)23-8-10-24(11-9-23)21(28)30-22(2,3)4/h6-7,12,16H,8-11,13-14H2,1-5H3