(2E,4E)-5-[5-phenylmethoxy-1-(phenylmethyl)indol-3-yl]penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-5-[5-phenylmethoxy-1-(phenylmethyl)indol-3-yl]penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-(1-benzyl-5-benzyloxy-indol-3-yl)penta-2,4-dienoic acid CAS Name: (2E,4E)-5-[5-phenylmethoxy-1-(phenylmethyl)-3-indolyl]penta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-(1-benzyl-5-phenylmethoxyindol-3-yl)penta-2,4-dienoic acid Traditional Name: (2E,4E)-5-(5-benzoxy-1-benzyl-indol-3-yl)penta-2,4-dienoic acid Formula: C27H23NO3 MolecularWeight: 409.47642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)C=CC=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)OCC4=CC=CC=C4)/C=C/C=C/C(=O)O

InChI

InChI=1S/C27H23NO3/c29-27(30)14-8-7-13-23-19-28(18-21-9-3-1-4-10-21)26-16-15-24(17-25(23)26)31-20-22-11-5-2-6-12-22/h1-17,19H,18,20H2,(H,29,30)/b13-7+,14-8+