2-(5-bromanyl-7-methylsulfanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)propanoic acid

Systemtic Name: 2-(5-bromanyl-7-methylsulfanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)propanoic acid Openeye Name: 2-(5-bromo-7-methylsulfanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)propanoic acid CAS Name: 2-[5-bromo-7-(methylthio)-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl]propanoic acid IUPAC Name: 2-(5-bromo-7-methylsulfanyl-2,3-dihydro-1H-pyrrolo[1,2-a]indol-3-yl)propanoic acid Traditional Name: 2-[5-bromo-7-(methylthio)-2,3-dihydro-1H-pyrrol[1,2-a]indol-3-yl]propionic acid Formula: C15H16BrNO2S MolecularWeight: 354.26204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCN2C1=CC3=C(C=C(C=C32)SC)Br)C(=O)O

Isomeric SMILES

CC(C1CCN2C1=CC3=C(C=C(C=C32)SC)Br)C(=O)O

InChI

InChI=1S/C15H16BrNO2S/c1-8(15(18)19)10-3-4-17-13-6-9(20-2)5-12(16)11(13)7-14(10)17/h5-8,10H,3-4H2,1-2H3,(H,18,19)