N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-1-keto-2-(2-methoxyethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H27FN2O5 MolecularWeight: 478.512083

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=C(C=CC(=C3)OC)OC)C4=CC=C(C=C4)F

Isomeric SMILES

COCCN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=C(C=CC(=C3)OC)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN2O5/c1-33-15-14-30-25(17-8-10-18(28)11-9-17)24(20-6-4-5-7-21(20)27(30)32)26(31)29-22-16-19(34-2)12-13-23(22)35-3/h4-13,16,24-25H,14-15H2,1-3H3,(H,29,31)