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

Systemtic Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylpyrazol-4-yl)prop-2-en-1-one Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C=CC3=CN(N=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)/C=C/C3=CN(N=C3)C)OCC

InChI

InChI=1S/C20H25N3O3/c1-4-25-18-10-16-8-9-23(14-17(16)11-19(18)26-5-2)20(24)7-6-15-12-21-22(3)13-15/h6-7,10-13H,4-5,8-9,14H2,1-3H3/b7-6+