(E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one Openeye Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitro-2-furyl)prop-2-en-1-one CAS Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitro-2-furanyl)-2-propen-1-one IUPAC Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitrofuran-2-yl)prop-2-en-1-one Traditional Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-nitro-2-furyl)prop-2-en-1-one Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C=CC3=CC=C(O3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-])OCC

InChI

InChI=1S/C20H22N2O6/c1-3-26-17-11-14-9-10-21(13-15(14)12-18(17)27-4-2)19(23)7-5-16-6-8-20(28-16)22(24)25/h5-8,11-12H,3-4,9-10,13H2,1-2H3/b7-5+