1-chloranyl-N-pentan-3-yl-isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-pentan-3-yl-isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-(1-ethylpropyl)isoquinoline-3-carboxamide CAS Name: 1-chloro-N-pentan-3-yl-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-pentan-3-ylisoquinoline-3-carboxamide Traditional Name: 1-chloro-N-(1-ethylpropyl)isoquinoline-3-carboxamide Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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