ethyl 2-[[4-[(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]ethanoate

Systemtic Name: ethyl 2-[[4-[(7-chloranyl-1-oxidanylidene-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]ethanoate Openeye Name: ethyl 2-[[4-[(7-chloro-1-oxo-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]acetate CAS Name: 2-[[4-[(7-chloro-1-oxo-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(7-chloro-1-oxo-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]acetate Traditional Name: 2-[[4-[(7-chloro-1-keto-2H-isoquinolin-6-yl)oxy]cyclohexyl]amino]acetic acid ethyl ester Formula: C19H23ClN2O4 MolecularWeight: 378.84992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1CCC(CC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl

Isomeric SMILES

CCOC(=O)CNC1CCC(CC1)OC2=C(C=C3C(=C2)C=CNC3=O)Cl

InChI

InChI=1S/C19H23ClN2O4/c1-2-25-18(23)11-22-13-3-5-14(6-4-13)26-17-9-12-7-8-21-19(24)15(12)10-16(17)20/h7-10,13-14,22H,2-6,11H2,1H3,(H,21,24)