1-[3,5-bis(chloranyl)phenyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile

Systemtic Name: 1-[3,5-bis(chloranyl)phenyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Openeye Name: 1-(3,5-dichlorophenyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile CAS Name: 1-(3,5-dichlorophenyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile IUPAC Name: 1-(3,5-dichlorophenyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Traditional Name: 1-(3,5-dichlorophenyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbonitrile Formula: C17H14Cl2N2O MolecularWeight: 333.21186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(N(CC2)C#N)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(N(CC2)C#N)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2N2O/c1-22-15-2-3-16-11(8-15)4-5-21(10-20)17(16)12-6-13(18)9-14(19)7-12/h2-3,6-9,17H,4-5H2,1H3