1-[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]butan-1-one

Systemtic Name: 1-[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]butan-1-one Openeye Name: 1-[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]butan-1-one CAS Name: 1-[1-[2-(4-methylphenoxy)ethyl]-3-indolyl]-1-butanone IUPAC Name: 1-[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]butan-1-one Traditional Name: 1-[1-[2-(4-methylphenoxy)ethyl]indol-3-yl]butan-1-one Formula: C21H23NO2 MolecularWeight: 321.41282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN(C2=CC=CC=C21)CCOC3=CC=C(C=C3)C

Isomeric SMILES

CCCC(=O)C1=CN(C2=CC=CC=C21)CCOC3=CC=C(C=C3)C

InChI

InChI=1S/C21H23NO2/c1-3-6-21(23)19-15-22(20-8-5-4-7-18(19)20)13-14-24-17-11-9-16(2)10-12-17/h4-5,7-12,15H,3,6,13-14H2,1-2H3