N-butyl-1-chloranyl-N-ethyl-isoquinoline-3-carboxamide

Systemtic Name: N-butyl-1-chloranyl-N-ethyl-isoquinoline-3-carboxamide Openeye Name: N-butyl-1-chloro-N-ethyl-isoquinoline-3-carboxamide CAS Name: N-butyl-1-chloro-N-ethyl-3-isoquinolinecarboxamide IUPAC Name: N-butyl-1-chloro-N-ethylisoquinoline-3-carboxamide Traditional Name: N-butyl-1-chloro-N-ethyl-isoquinoline-3-carboxamide Formula: C16H19ClN2O MolecularWeight: 290.78786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)C1=CC2=CC=CC=C2C(=N1)Cl

Isomeric SMILES

CCCCN(CC)C(=O)C1=CC2=CC=CC=C2C(=N1)Cl

InChI

InChI=1S/C16H19ClN2O/c1-3-5-10-19(4-2)16(20)14-11-12-8-6-7-9-13(12)15(17)18-14/h6-9,11H,3-5,10H2,1-2H3