2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-(4-fluorobenzyl)-1-keto-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H27FN2O4 MolecularWeight: 462.512683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1C(N(C(=O)C2=CC=CC=C12)CC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC

Isomeric SMILES

COCCNC(=O)C1C(N(C(=O)C2=CC=CC=C12)CC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H27FN2O4/c1-33-16-15-29-26(31)24-22-5-3-4-6-23(22)27(32)30(17-18-7-11-20(28)12-8-18)25(24)19-9-13-21(34-2)14-10-19/h3-14,24-25H,15-17H2,1-2H3,(H,29,31)