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

Systemtic Name: 3-(4-fluorophenyl)-N,2-bis(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N,2-bis(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N,2-bis(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 3-(4-fluorophenyl)-N,2-bis(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-1-keto-N,2-bis(2-methoxyethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C22H25FN2O4 MolecularWeight: 400.443303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1C(N(C(=O)C2=CC=CC=C12)CCOC)C3=CC=C(C=C3)F

Isomeric SMILES

COCCNC(=O)C1C(N(C(=O)C2=CC=CC=C12)CCOC)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O4/c1-28-13-11-24-21(26)19-17-5-3-4-6-18(17)22(27)25(12-14-29-2)20(19)15-7-9-16(23)10-8-15/h3-10,19-20H,11-14H2,1-2H3,(H,24,26)