(E,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxy-non-7-en-3-one

Systemtic Name: (E,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxy-non-7-en-3-one Openeye Name: (E,4R,5S,6S)-5-benzyloxy-4,6-dimethyl-non-7-en-3-one CAS Name: (E,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxy-7-nonen-3-one IUPAC Name: (E,4R,5S,6S)-4,6-dimethyl-5-phenylmethoxynon-7-en-3-one Traditional Name: (E,4R,5S,6S)-5-benzoxy-4,6-dimethyl-non-7-en-3-one Formula: C18H26O2 MolecularWeight: 274.39784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)C(C(C)C=CC)OCC1=CC=CC=C1

Isomeric SMILES

CCC(=O)[C@H](C)[C@H]([C@@H](C)/C=C/C)OCC1=CC=CC=C1

InChI

InChI=1S/C18H26O2/c1-5-10-14(3)18(15(4)17(19)6-2)20-13-16-11-8-7-9-12-16/h5,7-12,14-15,18H,6,13H2,1-4H3/b10-5+/t14-,15-,18-/m0/s1