4-[(E)-5-phenylmethoxy-3-(phenylmethoxymethyl)pent-4-enoyl]benzoic acid

Systemtic Name: 4-[(E)-5-phenylmethoxy-3-(phenylmethoxymethyl)pent-4-enoyl]benzoic acid Openeye Name: 4-[(E)-5-benzyloxy-3-(benzyloxymethyl)pent-4-enoyl]benzoic acid CAS Name: 4-[(E)-1-oxo-5-phenylmethoxy-3-(phenylmethoxymethyl)pent-4-enyl]benzoic acid IUPAC Name: 4-[(E)-5-phenylmethoxy-3-(phenylmethoxymethyl)pent-4-enoyl]benzoic acid Traditional Name: 4-[(E)-5-benzoxy-3-(benzoxymethyl)pent-4-enoyl]benzoic acid Formula: C27H26O5 MolecularWeight: 430.49234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CC(=O)C2=CC=C(C=C2)C(=O)O)C=COCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COCC(CC(=O)C2=CC=C(C=C2)C(=O)O)/C=C/OCC3=CC=CC=C3

InChI

InChI=1S/C27H26O5/c28-26(24-11-13-25(14-12-24)27(29)30)17-23(20-32-19-22-9-5-2-6-10-22)15-16-31-18-21-7-3-1-4-8-21/h1-16,23H,17-20H2,(H,29,30)/b16-15+