2-(2-chlorophenyl)carbonyl-3-methyl-1-propan-2-yl-isoquinoline-1-carbonitrile

Systemtic Name: 2-(2-chlorophenyl)carbonyl-3-methyl-1-propan-2-yl-isoquinoline-1-carbonitrile Openeye Name: 2-(2-chlorobenzoyl)-1-isopropyl-3-methyl-isoquinoline-1-carbonitrile CAS Name: 2-[(2-chlorophenyl)-oxomethyl]-3-methyl-1-propan-2-yl-1-isoquinolinecarbonitrile IUPAC Name: 2-(2-chlorobenzoyl)-3-methyl-1-propan-2-ylisoquinoline-1-carbonitrile Traditional Name: 2-(2-chlorobenzoyl)-1-isopropyl-3-methyl-isoquinoline-1-carbonitrile Formula: C21H19ClN2O MolecularWeight: 350.84136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(N1C(=O)C3=CC=CC=C3Cl)(C#N)C(C)C

Isomeric SMILES

CC1=CC2=CC=CC=C2C(N1C(=O)C3=CC=CC=C3Cl)(C#N)C(C)C

InChI

InChI=1S/C21H19ClN2O/c1-14(2)21(13-23)18-10-6-4-8-16(18)12-15(3)24(21)20(25)17-9-5-7-11-19(17)22/h4-12,14H,1-3H3