N-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

Systemtic Name: N-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Openeye Name: N-[2-(2-fluoro-4-methyl-anilino)-2-oxo-ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide CAS Name: N-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide IUPAC Name: N-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Traditional Name: N-[2-(2-fluoro-4-methyl-anilino)-2-keto-ethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide Formula: C19H20FN3O2 MolecularWeight: 341.379403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CNC(=O)C2CC3=CC=CC=C3CN2)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CNC(=O)C2CC3=CC=CC=C3CN2)F

InChI

InChI=1S/C19H20FN3O2/c1-12-6-7-16(15(20)8-12)23-18(24)11-22-19(25)17-9-13-4-2-3-5-14(13)10-21-17/h2-8,17,21H,9-11H2,1H3,(H,22,25)(H,23,24)