ethyl (4E)-3-ethyl-8-fluoranyl-1,2,6,11-tetrahydroazocino[4,5-b]indole-5-carboxylate

Systemtic Name: ethyl (4E)-3-ethyl-8-fluoranyl-1,2,6,11-tetrahydroazocino[4,5-b]indole-5-carboxylate Openeye Name: ethyl (4E)-3-ethyl-8-fluoro-1,2,6,11-tetrahydroazocino[4,5-b]indole-5-carboxylate CAS Name: (4E)-3-ethyl-8-fluoro-1,2,6,11-tetrahydroazocino[4,5-b]indole-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4E)-3-ethyl-8-fluoro-1,2,6,11-tetrahydroazocino[4,5-b]indole-5-carboxylate Traditional Name: (4E)-3-ethyl-8-fluoro-1,2,6,11-tetrahydroazocin[4,5-b]indole-5-carboxylic acid ethyl ester Formula: C18H21FN2O2 MolecularWeight: 316.369943

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(CC(=C1)C(=O)OCC)C3=C(N2)C=CC(=C3)F

Isomeric SMILES

CCN/1CCC2=C(C/C(=C1)/C(=O)OCC)C3=C(N2)C=CC(=C3)F

InChI

InChI=1S/C18H21FN2O2/c1-3-21-8-7-17-14(9-12(11-21)18(22)23-4-2)15-10-13(19)5-6-16(15)20-17/h5-6,10-11,20H,3-4,7-9H2,1-2H3/b12-11+