N-tert-butyl-1-(2-chlorophenyl)isoquinoline-3-carboxamide

Systemtic Name: N-tert-butyl-1-(2-chlorophenyl)isoquinoline-3-carboxamide Openeye Name: N-tert-butyl-1-(2-chlorophenyl)isoquinoline-3-carboxamide CAS Name: N-tert-butyl-1-(2-chlorophenyl)-3-isoquinolinecarboxamide IUPAC Name: N-tert-butyl-1-(2-chlorophenyl)isoquinoline-3-carboxamide Traditional Name: N-tert-butyl-1-(2-chlorophenyl)isoquinoline-3-carboxamide Formula: C20H19ClN2O MolecularWeight: 338.83066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H19ClN2O/c1-20(2,3)23-19(24)17-12-13-8-4-5-9-14(13)18(22-17)15-10-6-7-11-16(15)21/h4-12H,1-3H3,(H,23,24)