triethyl [(1S)-6-fluoranyl-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylate

Systemtic Name: triethyl [(1S)-6-fluoranyl-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylate Openeye Name: triethyl [(1S)-9-benzyl-6-fluoro-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylate CAS Name: [(1S)-6-fluoro-9-(phenylmethyl)-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylic acid triethyl ester IUPAC Name: triethyl [(1S)-9-benzyl-6-fluoro-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylate Traditional Name: [(1S)-9-benzyl-6-fluoro-1,2,3,4-tetrahydrocarbazol-1-yl]methanetricarboxylic acid triethyl ester Formula: C29H32FNO6 MolecularWeight: 509.565883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCC2=C1N(C3=C2C=C(C=C3)F)CC4=CC=CC=C4)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C([C@@H]1CCCC2=C1N(C3=C2C=C(C=C3)F)CC4=CC=CC=C4)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C29H32FNO6/c1-4-35-26(32)29(27(33)36-5-2,28(34)37-6-3)23-14-10-13-21-22-17-20(30)15-16-24(22)31(25(21)23)18-19-11-8-7-9-12-19/h7-9,11-12,15-17,23H,4-6,10,13-14,18H2,1-3H3/t23-/m1/s1