2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one

Systemtic Name: 2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one CAS Name: 2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one IUPAC Name: 2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 2-(4-chlorophenyl)-6,7-diethoxy-1-(4-ethylphenyl)-1,4-dihydroisoquinolin-3-one Formula: C27H28ClNO3 MolecularWeight: 449.96912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C3=CC(=C(C=C3CC(=O)N2C4=CC=C(C=C4)Cl)OCC)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C2C3=CC(=C(C=C3CC(=O)N2C4=CC=C(C=C4)Cl)OCC)OCC

InChI

InChI=1S/C27H28ClNO3/c1-4-18-7-9-19(10-8-18)27-23-17-25(32-6-3)24(31-5-2)15-20(23)16-26(30)29(27)22-13-11-21(28)12-14-22/h7-15,17,27H,4-6,16H2,1-3H3