tert-butyl 4-[(E)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)but-1-enyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(E)-4-methoxy-4-oxidanylidene-3-(phenylmethoxycarbonylamino)but-1-enyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(E)-3-(benzyloxycarbonylamino)-4-methoxy-4-oxo-but-1-enyl]piperidine-1-carboxylate CAS Name: 4-[(E)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)but-1-enyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)but-1-enyl]piperidine-1-carboxylate Traditional Name: 4-[(E)-3-(benzyloxycarbonylamino)-4-keto-4-methoxy-but-1-enyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C=CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)/C=C/C(C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H32N2O6/c1-23(2,3)31-22(28)25-14-12-17(13-15-25)10-11-19(20(26)29-4)24-21(27)30-16-18-8-6-5-7-9-18/h5-11,17,19H,12-16H2,1-4H3,(H,24,27)/b11-10+