6,7-diethoxy-1-phenyl-2-(4-propan-2-ylphenyl)-1,4-dihydroisoquinolin-3-one

Systemtic Name: 6,7-diethoxy-1-phenyl-2-(4-propan-2-ylphenyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 6,7-diethoxy-2-(4-isopropylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one CAS Name: 6,7-diethoxy-1-phenyl-2-(4-propan-2-ylphenyl)-1,4-dihydroisoquinolin-3-one IUPAC Name: 6,7-diethoxy-1-phenyl-2-(4-propan-2-ylphenyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 6,7-diethoxy-2-p-cumenyl-1-phenyl-1,4-dihydroisoquinolin-3-one Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=C(C=C3)C(C)C)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=C(C=C3)C(C)C)C4=CC=CC=C4)OCC

InChI

InChI=1S/C28H31NO3/c1-5-31-25-16-22-17-27(30)29(23-14-12-20(13-15-23)19(3)4)28(21-10-8-7-9-11-21)24(22)18-26(25)32-6-2/h7-16,18-19,28H,5-6,17H2,1-4H3