3-bromanyl-4-(phenylmethyl)-1-propan-2-ylsulfonyl-pyrrole

Systemtic Name: 3-bromanyl-4-(phenylmethyl)-1-propan-2-ylsulfonyl-pyrrole Openeye Name: 3-benzyl-4-bromo-1-isopropylsulfonyl-pyrrole CAS Name: 3-bromo-4-(phenylmethyl)-1-propan-2-ylsulfonylpyrrole IUPAC Name: 3-benzyl-4-bromo-1-propan-2-ylsulfonylpyrrole Traditional Name: 3-benzyl-4-bromo-1-isopropylsulfonyl-pyrrole Formula: C14H16BrNO2S MolecularWeight: 342.25134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C=C(C(=C1)Br)CC2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)N1C=C(C(=C1)Br)CC2=CC=CC=C2

InChI

InChI=1S/C14H16BrNO2S/c1-11(2)19(17,18)16-9-13(14(15)10-16)8-12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3