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

Systemtic Name: (2E,4E)-2-ethyl-5-[1-(phenylmethyl)indol-3-yl]penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-(1-benzylindol-3-yl)-2-ethyl-penta-2,4-dienoic acid CAS Name: (2E,4E)-2-ethyl-5-[1-(phenylmethyl)-3-indolyl]penta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-(1-benzylindol-3-yl)-2-ethylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-(1-benzylindol-3-yl)-2-ethyl-penta-2,4-dienoic acid Formula: C22H21NO2 MolecularWeight: 331.40764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC=CC1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC/C(=C\C=C\C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)/C(=O)O

InChI

InChI=1S/C22H21NO2/c1-2-18(22(24)25)11-8-12-19-16-23(15-17-9-4-3-5-10-17)21-14-7-6-13-20(19)21/h3-14,16H,2,15H2,1H3,(H,24,25)/b12-8+,18-11+