2-(3-bromanyl-4-propan-2-ylsulfonyl-pyrrol-1-yl)phenol

Systemtic Name: 2-(3-bromanyl-4-propan-2-ylsulfonyl-pyrrol-1-yl)phenol Openeye Name: 2-(3-bromo-4-isopropylsulfonyl-pyrrol-1-yl)phenol CAS Name: 2-(3-bromo-4-propan-2-ylsulfonyl-1-pyrrolyl)phenol IUPAC Name: 2-(3-bromo-4-propan-2-ylsulfonylpyrrol-1-yl)phenol Traditional Name: 2-(3-bromo-4-isopropylsulfonyl-pyrrol-1-yl)phenol Formula: C13H14BrNO3S MolecularWeight: 344.22416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CN(C=C1Br)C2=CC=CC=C2O

Isomeric SMILES

CC(C)S(=O)(=O)C1=CN(C=C1Br)C2=CC=CC=C2O

InChI

InChI=1S/C13H14BrNO3S/c1-9(2)19(17,18)13-8-15(7-10(13)14)11-5-3-4-6-12(11)16/h3-9,16H,1-2H3