1-chloranyl-N-methyl-N-pentan-2-yl-isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-methyl-N-pentan-2-yl-isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-methyl-N-(1-methylbutyl)isoquinoline-3-carboxamide CAS Name: 1-chloro-N-methyl-N-pentan-2-yl-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-methyl-N-pentan-2-ylisoquinoline-3-carboxamide Traditional Name: 1-chloro-N-methyl-N-(1-methylbutyl)isoquinoline-3-carboxamide Formula: C16H19ClN2O MolecularWeight: 290.78786

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N(C)C(=O)C1=CC2=CC=CC=C2C(=N1)Cl

Isomeric SMILES

CCCC(C)N(C)C(=O)C1=CC2=CC=CC=C2C(=N1)Cl

InChI

InChI=1S/C16H19ClN2O/c1-4-7-11(2)19(3)16(20)14-10-12-8-5-6-9-13(12)15(17)18-14/h5-6,8-11H,4,7H2,1-3H3