tert-butyl N-[(3S)-2-methyl-4-oxidanylidene-6-phenyl-hex-5-yn-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S)-2-methyl-4-oxidanylidene-6-phenyl-hex-5-yn-3-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-isopropyl-2-oxo-4-phenyl-but-3-ynyl]carbamate CAS Name: N-[(3S)-2-methyl-4-oxo-6-phenylhex-5-yn-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-2-methyl-4-oxo-6-phenylhex-5-yn-3-yl]carbamate Traditional Name: N-[(1S)-1-isopropyl-2-keto-4-phenyl-but-3-ynyl]carbamic acid tert-butyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO3/c1-13(2)16(19-17(21)22-18(3,4)5)15(20)12-11-14-9-7-6-8-10-14/h6-10,13,16H,1-5H3,(H,19,21)/t16-/m0/s1