[2-(4-ethoxy-4-oxidanylidene-butyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]azanium chloride

Systemtic Name: [2-(4-ethoxy-4-oxidanylidene-butyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl]azanium chloride Openeye Name: [2-(4-ethoxy-4-oxo-butyl)-6,7-dimethoxy-1-oxo-4-isoquinolyl]ammonium chloride CAS Name: [2-(4-ethoxy-4-oxobutyl)-6,7-dimethoxy-1-oxo-4-isoquinolinyl]ammonium chloride IUPAC Name: [2-(4-ethoxy-4-oxobutyl)-6,7-dimethoxy-1-oxoisoquinolin-4-yl]azanium chloride Traditional Name: [2-(4-ethoxy-4-keto-butyl)-1-keto-6,7-dimethoxy-4-isoquinolyl]ammonium chloride Formula: C17H23ClN2O5 MolecularWeight: 370.82792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)[NH3+].[Cl-]

InChI

InChI=1S/C17H22N2O5.ClH/c1-4-24-16(20)6-5-7-19-10-13(18)11-8-14(22-2)15(23-3)9-12(11)17(19)21;/h8-10H,4-7,18H2,1-3H3;1H