2-[4-(4-chlorophenyl)sulfanyl-7-fluoranyl-5-propyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]ethanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)sulfanyl-7-fluoranyl-5-propyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]ethanoic acid Openeye Name: 2-[4-(4-chlorophenyl)sulfanyl-7-fluoro-5-propyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetic acid CAS Name: 2-[4-[(4-chlorophenyl)thio]-7-fluoro-5-propyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetic acid IUPAC Name: 2-[4-(4-chlorophenyl)sulfanyl-7-fluoro-5-propyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]acetic acid Traditional Name: 2-[4-[(4-chlorophenyl)thio]-7-fluoro-5-propyl-2,3-dihydro-1H-pyrrol[1,2-a]indol-3-yl]acetic acid Formula: C22H21ClFNO2S MolecularWeight: 417.924043

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC2=C1C(=C3N2CCC3CC(=O)O)SC4=CC=C(C=C4)Cl)F

Isomeric SMILES

CCCC1=CC(=CC2=C1C(=C3N2CCC3CC(=O)O)SC4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C22H21ClFNO2S/c1-2-3-13-10-16(24)12-18-20(13)22(28-17-6-4-15(23)5-7-17)21-14(11-19(26)27)8-9-25(18)21/h4-7,10,12,14H,2-3,8-9,11H2,1H3,(H,26,27)