tert-butyl 4-[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-[(3,5-dimethylphenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(3,5-dimethylbenzoyl)nipecotoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O4 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C24H35N3O4/c1-17-13-18(2)15-20(14-17)22(29)27-8-6-7-19(16-27)21(28)25-9-11-26(12-10-25)23(30)31-24(3,4)5/h13-15,19H,6-12,16H2,1-5H3