1-chloranyl-N-(2-methylbutan-2-yl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-(2-methylbutan-2-yl)isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-(1,1-dimethylpropyl)isoquinoline-3-carboxamide CAS Name: 1-chloro-N-(2-methylbutan-2-yl)-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-(2-methylbutan-2-yl)isoquinoline-3-carboxamide Traditional Name: N-tert-amyl-1-chloro-isoquinoline-3-carboxamide Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1=CC2=CC=CC=C2C(=N1)Cl

Isomeric SMILES

CCC(C)(C)NC(=O)C1=CC2=CC=CC=C2C(=N1)Cl

InChI

InChI=1S/C15H17ClN2O/c1-4-15(2,3)18-14(19)12-9-10-7-5-6-8-11(10)13(16)17-12/h5-9H,4H2,1-3H3,(H,18,19)