1-chloranyl-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-[2-(dimethylamino)-2-oxo-ethyl]-N-methyl-isoquinoline-3-carboxamide CAS Name: 1-chloro-N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-[2-(dimethylamino)-2-oxoethyl]-N-methylisoquinoline-3-carboxamide Traditional Name: 1-chloro-N-[2-(dimethylamino)-2-keto-ethyl]-N-methyl-isoquinoline-3-carboxamide Formula: C15H16ClN3O2 MolecularWeight: 305.75944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClN3O2/c1-18(2)13(20)9-19(3)15(21)12-8-10-6-4-5-7-11(10)14(16)17-12/h4-8H,9H2,1-3H3