propan-2-yl (E)-2,5-dideuterio-2-phenyl-oct-3-enoate

Systemtic Name: propan-2-yl (E)-2,5-dideuterio-2-phenyl-oct-3-enoate Openeye Name: isopropyl (E)-2,5-dideuterio-2-phenyl-oct-3-enoate CAS Name: (E)-2,5-dideuterio-2-phenyl-3-octenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-2,5-dideuterio-2-phenyloct-3-enoate Traditional Name: (E)-2,5-dideuterio-2-phenyl-oct-3-enoic acid isopropyl ester Formula: C17H24O2 MolecularWeight: 262.383584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C(CCC)/C=C/C([2H])(C1=CC=CC=C1)C(=O)OC(C)C

InChI

InChI=1S/C17H24O2/c1-4-5-6-10-13-16(17(18)19-14(2)3)15-11-8-7-9-12-15/h7-14,16H,4-6H2,1-3H3/b13-10+/i6D,16D