1-chloranyl-N-pentyl-isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-pentyl-isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-pentyl-isoquinoline-3-carboxamide CAS Name: 1-chloro-N-pentyl-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-pentylisoquinoline-3-carboxamide Traditional Name: N-amyl-1-chloro-isoquinoline-3-carboxamide Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC2=CC=CC=C2C(=N1)Cl

Isomeric SMILES

CCCCCNC(=O)C1=CC2=CC=CC=C2C(=N1)Cl

InChI

InChI=1S/C15H17ClN2O/c1-2-3-6-9-17-15(19)13-10-11-7-4-5-8-12(11)14(16)18-13/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,17,19)