(2R,3S,5Z)-2-hept-1-ynyl-3-phenylmethoxy-3,4,7,8-tetrahydro-2H-oxocine

Systemtic Name: (2R,3S,5Z)-2-hept-1-ynyl-3-phenylmethoxy-3,4,7,8-tetrahydro-2H-oxocine Openeye Name: (2R,3S,5Z)-3-benzyloxy-2-hept-1-ynyl-3,4,7,8-tetrahydro-2H-oxocine CAS Name: (2R,3S,5Z)-2-hept-1-ynyl-3-phenylmethoxy-3,4,7,8-tetrahydro-2H-oxocin IUPAC Name: (2R,3S,5Z)-2-hept-1-ynyl-3-phenylmethoxy-3,4,7,8-tetrahydro-2H-oxocine Traditional Name: (2R,3S,5Z)-3-benzoxy-2-hept-1-ynyl-3,4,7,8-tetrahydro-2H-oxocin Formula: C21H28O2 MolecularWeight: 312.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1C(CC=CCCO1)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC#C[C@@H]1[C@H](C/C=C\CCO1)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28O2/c1-2-3-4-5-10-15-20-21(16-11-7-12-17-22-20)23-18-19-13-8-6-9-14-19/h6-9,11,13-14,20-21H,2-5,12,16-18H2,1H3/b11-7-/t20-,21+/m1/s1