tert-butyl 3-[(E)-3-[3-(2-ethoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]azetidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(E)-3-[3-(2-ethoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]-3-oxidanylidene-prop-1-enyl]azetidine-1-carboxylate Openeye Name: tert-butyl 3-[(E)-3-[3-(2-ethoxycarbonylbut-3-ynylcarbamoyl)-1-piperidyl]-3-oxo-prop-1-enyl]azetidine-1-carboxylate CAS Name: 3-[(E)-3-[3-[(2-ethoxycarbonylbut-3-ynylamino)-oxomethyl]-1-piperidinyl]-3-oxoprop-1-enyl]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(E)-3-[3-(2-ethoxycarbonylbut-3-ynylcarbamoyl)piperidin-1-yl]-3-oxoprop-1-enyl]azetidine-1-carboxylate Traditional Name: 3-[(E)-3-[3-(2-carbethoxybut-3-ynylcarbamoyl)piperidino]-3-keto-prop-1-enyl]azetidine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O6 MolecularWeight: 461.5512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNC(=O)C1CCCN(C1)C(=O)C=CC2CN(C2)C(=O)OC(C)(C)C)C#C

Isomeric SMILES

CCOC(=O)C(CNC(=O)C1CCCN(C1)C(=O)/C=C/C2CN(C2)C(=O)OC(C)(C)C)C#C

InChI

InChI=1S/C24H35N3O6/c1-6-18(22(30)32-7-2)13-25-21(29)19-9-8-12-26(16-19)20(28)11-10-17-14-27(15-17)23(31)33-24(3,4)5/h1,10-11,17-19H,7-9,12-16H2,2-5H3,(H,25,29)/b11-10+