1-chloranyl-N-(2-hydroxyethyl)-7-methoxy-4-oxidanyl-isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-(2-hydroxyethyl)-7-methoxy-4-oxidanyl-isoquinoline-3-carboxamide Openeye Name: 1-chloro-4-hydroxy-N-(2-hydroxyethyl)-7-methoxy-isoquinoline-3-carboxamide CAS Name: 1-chloro-4-hydroxy-N-(2-hydroxyethyl)-7-methoxy-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-4-hydroxy-N-(2-hydroxyethyl)-7-methoxyisoquinoline-3-carboxamide Traditional Name: 1-chloro-4-hydroxy-N-(2-hydroxyethyl)-7-methoxy-isoquinoline-3-carboxamide Formula: C13H13ClN2O4 MolecularWeight: 296.70632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N=C2Cl)C(=O)NCCO)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N=C2Cl)C(=O)NCCO)O

InChI

InChI=1S/C13H13ClN2O4/c1-20-7-2-3-8-9(6-7)12(14)16-10(11(8)18)13(19)15-4-5-17/h2-3,6,17-18H,4-5H2,1H3,(H,15,19)