tert-butyl N-[(1S,2S)-2-cyano-1-phenyl-2-(phenylcarbonyl)pent-4-enyl]carbamate

Systemtic Name: tert-butyl N-[(1S,2S)-2-cyano-1-phenyl-2-(phenylcarbonyl)pent-4-enyl]carbamate Openeye Name: tert-butyl N-[(1S,2S)-2-benzoyl-2-cyano-1-phenyl-pent-4-enyl]carbamate CAS Name: N-[(1S,2S)-2-benzoyl-2-cyano-1-phenylpent-4-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S,2S)-2-benzoyl-2-cyano-1-phenylpent-4-enyl]carbamate Traditional Name: N-[(1S,2S)-2-benzoyl-2-cyano-1-phenyl-pent-4-enyl]carbamic acid tert-butyl ester Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(CC=C)(C#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C1=CC=CC=C1)[C@@](CC=C)(C#N)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C24H26N2O3/c1-5-16-24(17-25,21(27)19-14-10-7-11-15-19)20(18-12-8-6-9-13-18)26-22(28)29-23(2,3)4/h5-15,20H,1,16H2,2-4H3,(H,26,28)/t20-,24+/m0/s1