tert-butyl N-[(2S)-1-(2-cyanoethylamino)-1-oxidanylidene-5-phenyl-pent-4-yn-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(2-cyanoethylamino)-1-oxidanylidene-5-phenyl-pent-4-yn-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(2-cyanoethylcarbamoyl)-4-phenyl-but-3-ynyl]carbamate CAS Name: N-[(2S)-1-(2-cyanoethylamino)-1-oxo-5-phenylpent-4-yn-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(2-cyanoethylamino)-1-oxo-5-phenylpent-4-yn-2-yl]carbamate Traditional Name: N-[(1S)-1-(2-cyanoethylcarbamoyl)-4-phenyl-but-3-ynyl]carbamic acid tert-butyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#CC1=CC=CC=C1)C(=O)NCCC#N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC#CC1=CC=CC=C1)C(=O)NCCC#N

InChI

InChI=1S/C19H23N3O3/c1-19(2,3)25-18(24)22-16(17(23)21-14-8-13-20)12-7-11-15-9-5-4-6-10-15/h4-6,9-10,16H,8,12,14H2,1-3H3,(H,21,23)(H,22,24)/t16-/m0/s1