tert-butyl N-[(4S,5S)-5-methyl-3-oxidanylidene-1-phenyl-hept-1-yn-4-yl]carbamate

Systemtic Name: tert-butyl N-[(4S,5S)-5-methyl-3-oxidanylidene-1-phenyl-hept-1-yn-4-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(1S)-1-methylpropyl]-2-oxo-4-phenyl-but-3-ynyl]carbamate CAS Name: N-[(4S,5S)-5-methyl-3-oxo-1-phenylhept-1-yn-4-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4S,5S)-5-methyl-3-oxo-1-phenylhept-1-yn-4-yl]carbamate Traditional Name: N-[(1S)-2-keto-1-[(1S)-1-methylpropyl]-4-phenyl-but-3-ynyl]carbamic acid tert-butyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)C#CC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO3/c1-6-14(2)17(20-18(22)23-19(3,4)5)16(21)13-12-15-10-8-7-9-11-15/h7-11,14,17H,6H2,1-5H3,(H,20,22)/t14-,17-/m0/s1