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

Systemtic Name: N-butyl-1-chloranyl-N-methyl-isoquinoline-3-carboxamide Openeye Name: N-butyl-1-chloro-N-methyl-isoquinoline-3-carboxamide CAS Name: N-butyl-1-chloro-N-methyl-3-isoquinolinecarboxamide IUPAC Name: N-butyl-1-chloro-N-methylisoquinoline-3-carboxamide Traditional Name: N-butyl-1-chloro-N-methyl-isoquinoline-3-carboxamide Formula: C15H17ClN2O MolecularWeight: 276.76128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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