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

Systemtic Name: 6,7-diethoxy-2-(4-ethylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one Openeye Name: 6,7-diethoxy-2-(4-ethylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one CAS Name: 6,7-diethoxy-2-(4-ethylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one IUPAC Name: 6,7-diethoxy-2-(4-ethylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one Traditional Name: 6,7-diethoxy-2-(4-ethylphenyl)-1-phenyl-1,4-dihydroisoquinolin-3-one Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(C3=CC(=C(C=C3CC2=O)OCC)OCC)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(C3=CC(=C(C=C3CC2=O)OCC)OCC)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO3/c1-4-19-12-14-22(15-13-19)28-26(29)17-21-16-24(30-5-2)25(31-6-3)18-23(21)27(28)20-10-8-7-9-11-20/h7-16,18,27H,4-6,17H2,1-3H3