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

Systemtic Name: N-butyl-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-butyl-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-butyl-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-butyl-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-butyl-3-(4-fluorophenyl)-1-keto-2-(2-methoxyethyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C23H27FN2O3 MolecularWeight: 398.470483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27FN2O3/c1-3-4-13-25-22(27)20-18-7-5-6-8-19(18)23(28)26(14-15-29-2)21(20)16-9-11-17(24)12-10-16/h5-12,20-21H,3-4,13-15H2,1-2H3,(H,25,27)