diethyl 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]propanedioate

Systemtic Name: diethyl 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]propanedioate Openeye Name: diethyl 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]propanedioate CAS Name: 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]propanedioate Traditional Name: 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)ethylidene]malonic acid diethyl ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)N1CCC2=CC=CC=C2C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C(C)N1CCC2=CC=CC=C2C1)C(=O)OCC

InChI

InChI=1S/C18H23NO4/c1-4-22-17(20)16(18(21)23-5-2)13(3)19-11-10-14-8-6-7-9-15(14)12-19/h6-9H,4-5,10-12H2,1-3H3