7,8-bis(chloranyl)-1-methyl-2-(phenylcarbonyl)isoquinoline-1-carbonitrile

Systemtic Name: 7,8-bis(chloranyl)-1-methyl-2-(phenylcarbonyl)isoquinoline-1-carbonitrile Openeye Name: 2-benzoyl-7,8-dichloro-1-methyl-isoquinoline-1-carbonitrile CAS Name: 2-benzoyl-7,8-dichloro-1-methyl-1-isoquinolinecarbonitrile IUPAC Name: 2-benzoyl-7,8-dichloro-1-methylisoquinoline-1-carbonitrile Traditional Name: 2-benzoyl-7,8-dichloro-1-methyl-isoquinoline-1-carbonitrile Formula: C18H12Cl2N2O MolecularWeight: 343.20668

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2Cl)Cl)C=CN1C(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1(C2=C(C=CC(=C2Cl)Cl)C=CN1C(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H12Cl2N2O/c1-18(11-21)15-12(7-8-14(19)16(15)20)9-10-22(18)17(23)13-5-3-2-4-6-13/h2-10H,1H3