(2R,7R)-2-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-7-[(1S)-1-phenylmethoxypropyl]-2,3,6,7-tetrahydrooxepine

Systemtic Name: (2R,7R)-2-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-7-[(1S)-1-phenylmethoxypropyl]-2,3,6,7-tetrahydrooxepine Openeye Name: (2R,7R)-2-[(1S)-1-benzyloxypropyl]-7-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-2,3,6,7-tetrahydrooxepine CAS Name: (2R,7R)-2-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-7-[(1S)-1-phenylmethoxypropyl]-2,3,6,7-tetrahydrooxepin IUPAC Name: (2R,7R)-2-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-7-[(1S)-1-phenylmethoxypropyl]-2,3,6,7-tetrahydrooxepine Traditional Name: (2R,7R)-2-[(1S)-1-benzoxypropyl]-7-[(1E,3Z)-hexa-1,3-dien-5-ynyl]-2,3,6,7-tetrahydrooxepin Formula: C22H26O2 MolecularWeight: 322.44064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CC=CCC(O1)C=CC=CC#C)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@@H]([C@H]1CC=CC[C@@H](O1)/C=C/C=C\C#C)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26O2/c1-3-5-6-10-15-20-16-11-12-17-22(24-20)21(4-2)23-18-19-13-8-7-9-14-19/h1,5-15,20-22H,4,16-18H2,2H3/b6-5-,15-10+/t20-,21-,22+/m0/s1