[(3S)-hept-1-yn-3-yl] N-[(1R)-1-phenylethyl]carbamate

Systemtic Name: [(3S)-hept-1-yn-3-yl] N-[(1R)-1-phenylethyl]carbamate Openeye Name: [(1S)-1-ethynylpentyl] N-[(1R)-1-phenylethyl]carbamate CAS Name: N-[(1R)-1-phenylethyl]carbamic acid [(3S)-hept-1-yn-3-yl] ester IUPAC Name: [(3S)-hept-1-yn-3-yl] N-[(1R)-1-phenylethyl]carbamate Traditional Name: N-[(1R)-1-phenylethyl]carbamic acid [(1S)-1-butylprop-2-ynyl] ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO2/c1-4-6-12-15(5-2)19-16(18)17-13(3)14-10-8-7-9-11-14/h2,7-11,13,15H,4,6,12H2,1,3H3,(H,17,18)/t13-,15-/m1/s1