tert-butyl 4-[3-oxidanylidene-3-[3-(2-phenoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-oxidanylidene-3-[3-(2-phenoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-oxo-3-[3-(2-phenoxycarbonylbut-3-ynylcarbamoyl)-1-piperidyl]propyl]piperidine-1-carboxylate CAS Name: 4-[3-oxo-3-[3-[oxo-[2-[oxo(phenoxy)methyl]but-3-ynylamino]methyl]-1-piperidinyl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-oxo-3-[3-(2-phenoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[3-(2-carbophenoxybut-3-ynylcarbamoyl)piperidino]-3-keto-propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H41N3O6 MolecularWeight: 539.66304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)N2CCCC(C2)C(=O)NCC(C#C)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)N2CCCC(C2)C(=O)NCC(C#C)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C30H41N3O6/c1-5-23(28(36)38-25-11-7-6-8-12-25)20-31-27(35)24-10-9-17-33(21-24)26(34)14-13-22-15-18-32(19-16-22)29(37)39-30(2,3)4/h1,6-8,11-12,22-24H,9-10,13-21H2,2-4H3,(H,31,35)