1-[(E)-2-(2,4-dichlorophenyl)ethenyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one

Systemtic Name: 1-[(E)-2-(2,4-dichlorophenyl)ethenyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one Openeye Name: 1-[(E)-2-(2,4-dichlorophenyl)vinyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one CAS Name: 1-[(E)-2-(2,4-dichlorophenyl)ethenyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one IUPAC Name: 1-[(E)-2-(2,4-dichlorophenyl)ethenyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one Traditional Name: 1-[(E)-2-(2,4-dichlorophenyl)vinyl]-7-methoxy-5-propyl-3,4-dihydro-2H-isoquinolin-6-one Formula: C21H21Cl2NO2 MolecularWeight: 390.30294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CCNC(=C2C=C(C1=O)OC)C=CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC1=C2CCNC(=C2C=C(C1=O)OC)/C=C/C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H21Cl2NO2/c1-3-4-16-15-9-10-24-19(17(15)12-20(26-2)21(16)25)8-6-13-5-7-14(22)11-18(13)23/h5-8,11-12,24H,3-4,9-10H2,1-2H3/b8-6+