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

Systemtic Name: 1-(4-chlorophenyl)-6,7-diethoxy-2-(3-methoxyphenyl)-1,4-dihydroisoquinolin-3-one Openeye Name: 1-(4-chlorophenyl)-6,7-diethoxy-2-(3-methoxyphenyl)-1,4-dihydroisoquinolin-3-one CAS Name: 1-(4-chlorophenyl)-6,7-diethoxy-2-(3-methoxyphenyl)-1,4-dihydroisoquinolin-3-one IUPAC Name: 1-(4-chlorophenyl)-6,7-diethoxy-2-(3-methoxyphenyl)-1,4-dihydroisoquinolin-3-one Traditional Name: 1-(4-chlorophenyl)-6,7-diethoxy-2-(3-methoxyphenyl)-1,4-dihydroisoquinolin-3-one Formula: C26H26ClNO4 MolecularWeight: 451.94194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26ClNO4/c1-4-31-23-13-18-14-25(29)28(20-7-6-8-21(15-20)30-3)26(17-9-11-19(27)12-10-17)22(18)16-24(23)32-5-2/h6-13,15-16,26H,4-5,14H2,1-3H3