ethyl 2-[2-(1-oxidanylidene-2-prop-2-enyl-isoquinolin-5-yl)oxyethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-(1-oxidanylidene-2-prop-2-enyl-isoquinolin-5-yl)oxyethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-[(2-allyl-1-oxo-5-isoquinolyl)oxy]acetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[(1-oxo-2-prop-2-enyl-5-isoquinolinyl)oxy]ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetyl]amino]acetate Traditional Name: 2-[[2-[(2-allyl-1-keto-5-isoquinolyl)oxy]acetyl]amino]acetic acid ethyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)COC1=CC=CC2=C1C=CN(C2=O)CC=C

Isomeric SMILES

CCOC(=O)CNC(=O)COC1=CC=CC2=C1C=CN(C2=O)CC=C

InChI

InChI=1S/C18H20N2O5/c1-3-9-20-10-8-13-14(18(20)23)6-5-7-15(13)25-12-16(21)19-11-17(22)24-4-2/h3,5-8,10H,1,4,9,11-12H2,2H3,(H,19,21)