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

Systemtic Name: 1-[1-[3-(4-methylphenoxy)propyl]indol-3-yl]butan-1-one Openeye Name: 1-[1-[3-(4-methylphenoxy)propyl]indol-3-yl]butan-1-one CAS Name: 1-[1-[3-(4-methylphenoxy)propyl]-3-indolyl]-1-butanone IUPAC Name: 1-[1-[3-(4-methylphenoxy)propyl]indol-3-yl]butan-1-one Traditional Name: 1-[1-[3-(4-methylphenoxy)propyl]indol-3-yl]butan-1-one Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN(C2=CC=CC=C21)CCCOC3=CC=C(C=C3)C

Isomeric SMILES

CCCC(=O)C1=CN(C2=CC=CC=C21)CCCOC3=CC=C(C=C3)C

InChI

InChI=1S/C22H25NO2/c1-3-7-22(24)20-16-23(21-9-5-4-8-19(20)21)14-6-15-25-18-12-10-17(2)11-13-18/h4-5,8-13,16H,3,6-7,14-15H2,1-2H3