1-chloranyl-N-(4-oxidanylcyclohexyl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-(4-oxidanylcyclohexyl)isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-(4-hydroxycyclohexyl)isoquinoline-3-carboxamide CAS Name: 1-chloro-N-(4-hydroxycyclohexyl)-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-(4-hydroxycyclohexyl)isoquinoline-3-carboxamide Traditional Name: 1-chloro-N-(4-hydroxycyclohexyl)isoquinoline-3-carboxamide Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC3=CC=CC=C3C(=N2)Cl)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC3=CC=CC=C3C(=N2)Cl)O

InChI

InChI=1S/C16H17ClN2O2/c17-15-13-4-2-1-3-10(13)9-14(19-15)16(21)18-11-5-7-12(20)8-6-11/h1-4,9,11-12,20H,5-8H2,(H,18,21)