1-chloranyl-N-methyl-N-(oxan-4-yl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-methyl-N-(oxan-4-yl)isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-methyl-N-tetrahydropyran-4-yl-isoquinoline-3-carboxamide CAS Name: 1-chloro-N-methyl-N-(4-oxanyl)-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-methyl-N-(oxan-4-yl)isoquinoline-3-carboxamide Traditional Name: 1-chloro-N-methyl-N-tetrahydropyran-4-yl-isoquinoline-3-carboxamide Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)C(=O)C2=CC3=CC=CC=C3C(=N2)Cl

Isomeric SMILES

CN(C1CCOCC1)C(=O)C2=CC3=CC=CC=C3C(=N2)Cl

InChI

InChI=1S/C16H17ClN2O2/c1-19(12-6-8-21-9-7-12)16(20)14-10-11-4-2-3-5-13(11)15(17)18-14/h2-5,10,12H,6-9H2,1H3