2-[(1R)-9-[(4-chlorophenyl)methyl]-6-fluoranyl-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]ethanoic acid

Systemtic Name: 2-[(1R)-9-[(4-chlorophenyl)methyl]-6-fluoranyl-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]ethanoic acid Openeye Name: 2-[(1R)-9-[(4-chlorophenyl)methyl]-6-fluoro-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]acetic acid CAS Name: 2-[(1R)-9-[(4-chlorophenyl)methyl]-6-fluoro-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]acetic acid IUPAC Name: 2-[(1R)-9-[(4-chlorophenyl)methyl]-6-fluoro-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]acetic acid Traditional Name: 2-[(1R)-9-(4-chlorobenzyl)-6-fluoro-8-[(S)-methylsulfinyl]-1,2,3,4-tetrahydrocarbazol-1-yl]acetic acid Formula: C22H21ClFNO3S MolecularWeight: 433.923443

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=C2C(=CC(=C1)F)C3=C(N2CC4=CC=C(C=C4)Cl)C(CCC3)CC(=O)O

Isomeric SMILES

C[S@](=O)C1=C2C(=CC(=C1)F)C3=C(N2CC4=CC=C(C=C4)Cl)[C@H](CCC3)CC(=O)O

InChI

InChI=1S/C22H21ClFNO3S/c1-29(28)19-11-16(24)10-18-17-4-2-3-14(9-20(26)27)21(17)25(22(18)19)12-13-5-7-15(23)8-6-13/h5-8,10-11,14H,2-4,9,12H2,1H3,(H,26,27)/t14-,29+/m1/s1