4-chloranyl-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]benzenecarboximidamide

Systemtic Name: 4-chloranyl-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]benzenecarboximidamide Openeye Name: 4-chloro-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]benzamidine CAS Name: 4-chloro-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzenecarboximidamide IUPAC Name: 4-chloro-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]benzenecarboximidamide Traditional Name: 4-chloro-N'-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]benzamidine Formula: C20H22ClN3O4 MolecularWeight: 403.85938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CON=C(C3=CC=C(C=C3)Cl)N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CO/N=C(/C3=CC=C(C=C3)Cl)\N)OC

InChI

InChI=1S/C20H22ClN3O4/c1-26-17-9-14-7-8-24(11-15(14)10-18(17)27-2)19(25)12-28-23-20(22)13-3-5-16(21)6-4-13/h3-6,9-10H,7-8,11-12H2,1-2H3,(H2,22,23)