1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)butan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)butan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)butan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)-1-butanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)butan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2,3-dimethylphenoxy)butan-1-one Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC2=CC=CC=C2C1)OC3=CC=CC(=C3C)C

Isomeric SMILES

CCC(C(=O)N1CCC2=CC=CC=C2C1)OC3=CC=CC(=C3C)C

InChI

InChI=1S/C21H25NO2/c1-4-19(24-20-11-7-8-15(2)16(20)3)21(23)22-13-12-17-9-5-6-10-18(17)14-22/h5-11,19H,4,12-14H2,1-3H3