2-[5-bromanyl-4-(4-chlorophenyl)sulfanyl-7-iodanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate

Systemtic Name: 2-[5-bromanyl-4-(4-chlorophenyl)sulfanyl-7-iodanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate Openeye Name: 2-[5-bromo-4-(4-chlorophenyl)sulfanyl-7-iodo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate CAS Name: 2-[5-bromo-4-[(4-chlorophenyl)thio]-7-iodo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate IUPAC Name: 2-[5-bromo-4-(4-chlorophenyl)sulfanyl-7-iodo-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoate Traditional Name: 2-[5-bromo-4-[(4-chlorophenyl)thio]-7-iodo-2,3-dihydro-1H-pyrrol[1,2-a]indol-3-yl]propionate Formula: C20H15BrClINO2S- MolecularWeight: 575.66507

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN2C1=C(C3=C(C=C(C=C32)I)Br)SC4=CC=C(C=C4)Cl)C(=O)[O-]

Isomeric SMILES

CC(C1CCN2C1=C(C3=C(C=C(C=C32)I)Br)SC4=CC=C(C=C4)Cl)C(=O)[O-]

InChI

InChI=1S/C20H16BrClINO2S/c1-10(20(25)26)14-6-7-24-16-9-12(23)8-15(21)17(16)19(18(14)24)27-13-4-2-11(22)3-5-13/h2-5,8-10,14H,6-7H2,1H3,(H,25,26)/p-1