2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoranyl-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoranyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoro-5-nitro-phenyl)acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoro-5-nitrophenyl)acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoro-5-nitrophenyl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-fluoro-5-nitro-phenyl)acetamide Formula: C17H16FN3O3 MolecularWeight: 329.325643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])F

InChI

InChI=1S/C17H16FN3O3/c18-15-6-5-14(21(23)24)9-16(15)19-17(22)11-20-8-7-12-3-1-2-4-13(12)10-20/h1-6,9H,7-8,10-11H2,(H,19,22)