2-(4-chlorophenyl)carbonyl-1-propan-2-yl-isoquinoline-1-carbonitrile

Systemtic Name: 2-(4-chlorophenyl)carbonyl-1-propan-2-yl-isoquinoline-1-carbonitrile Openeye Name: 2-(4-chlorobenzoyl)-1-isopropyl-isoquinoline-1-carbonitrile CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-1-propan-2-yl-1-isoquinolinecarbonitrile IUPAC Name: 2-(4-chlorobenzoyl)-1-propan-2-ylisoquinoline-1-carbonitrile Traditional Name: 2-(4-chlorobenzoyl)-1-isopropyl-isoquinoline-1-carbonitrile Formula: C20H17ClN2O MolecularWeight: 336.81478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C2=CC=CC=C2C=CN1C(=O)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC(C)C1(C2=CC=CC=C2C=CN1C(=O)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C20H17ClN2O/c1-14(2)20(13-22)18-6-4-3-5-15(18)11-12-23(20)19(24)16-7-9-17(21)10-8-16/h3-12,14H,1-2H3