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

Systemtic Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C=CC3=CN(N=C3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C25H27N3O3/c1-3-30-23-14-20-12-13-27(18-21(20)15-24(23)31-4-2)25(29)11-10-19-16-26-28(17-19)22-8-6-5-7-9-22/h5-11,14-17H,3-4,12-13,18H2,1-2H3/b11-10+