11-fluoranyl-8-pentyl-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine

Systemtic Name: 11-fluoranyl-8-pentyl-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine Openeye Name: 11-fluoro-8-pentyl-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine CAS Name: 11-fluoro-8-pentyl-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine IUPAC Name: 11-fluoro-8-pentyl-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine Traditional Name: 8-amyl-11-fluoro-5,6,14,14a-tetrahydroisoquinolino[2,1-c][1,3]benzodiazepine Formula: C22H25FN2 MolecularWeight: 336.445703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(CC3N1CCC4=CC=CC=C34)C=CC(=C2)F

Isomeric SMILES

CCCCCC1=NC2=C(CC3N1CCC4=CC=CC=C34)C=CC(=C2)F

InChI

InChI=1S/C22H25FN2/c1-2-3-4-9-22-24-20-15-18(23)11-10-17(20)14-21-19-8-6-5-7-16(19)12-13-25(21)22/h5-8,10-11,15,21H,2-4,9,12-14H2,1H3