[(3S)-oct-1-en-7-yn-3-yl] (2S)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(3S)-oct-1-en-7-yn-3-yl] (2S)-2-methoxy-2-phenyl-propanoate Openeye Name: [(1S)-1-vinylhex-5-ynyl] (2S)-2-methoxy-2-phenyl-propanoate CAS Name: (2S)-2-methoxy-2-phenylpropanoic acid [(3S)-oct-1-en-7-yn-3-yl] ester IUPAC Name: [(3S)-oct-1-en-7-yn-3-yl] (2S)-2-methoxy-2-phenylpropanoate Traditional Name: (2S)-2-methoxy-2-phenyl-propionic acid [(1S)-1-vinylhex-5-ynyl] ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(=O)OC(CCCC#C)C=C)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H22O3/c1-5-7-9-14-16(6-2)21-17(19)18(3,20-4)15-12-10-8-11-13-15/h1,6,8,10-13,16H,2,7,9,14H2,3-4H3/t16-,18+/m1/s1