1-(5-methylindol-1-yl)-3-(4-octylphenoxy)propan-2-one

Systemtic Name: 1-(5-methylindol-1-yl)-3-(4-octylphenoxy)propan-2-one Openeye Name: 1-(5-methylindol-1-yl)-3-(4-octylphenoxy)propan-2-one CAS Name: 1-(5-methyl-1-indolyl)-3-(4-octylphenoxy)-2-propanone IUPAC Name: 1-(5-methylindol-1-yl)-3-(4-octylphenoxy)propan-2-one Traditional Name: 1-(5-methylindol-1-yl)-3-(4-octylphenoxy)acetone Formula: C26H33NO2 MolecularWeight: 391.54572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OCC(=O)CN2C=CC3=C2C=CC(=C3)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OCC(=O)CN2C=CC3=C2C=CC(=C3)C

InChI

InChI=1S/C26H33NO2/c1-3-4-5-6-7-8-9-22-11-13-25(14-12-22)29-20-24(28)19-27-17-16-23-18-21(2)10-15-26(23)27/h10-18H,3-9,19-20H2,1-2H3