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

Systemtic Name: 1-[1-[2-(3,4-dimethylphenoxy)ethyl]indol-3-yl]butan-1-one Openeye Name: 1-[1-[2-(3,4-dimethylphenoxy)ethyl]indol-3-yl]butan-1-one CAS Name: 1-[1-[2-(3,4-dimethylphenoxy)ethyl]-3-indolyl]-1-butanone IUPAC Name: 1-[1-[2-(3,4-dimethylphenoxy)ethyl]indol-3-yl]butan-1-one Traditional Name: 1-[1-[2-(3,4-dimethylphenoxy)ethyl]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)CCOC3=CC(=C(C=C3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO2/c1-4-7-22(24)20-15-23(21-9-6-5-8-19(20)21)12-13-25-18-11-10-16(2)17(3)14-18/h5-6,8-11,14-15H,4,7,12-13H2,1-3H3