(5-bromanyl-1H-indol-7-yl) 4-methylbenzenesulfonate

Systemtic Name: (5-bromanyl-1H-indol-7-yl) 4-methylbenzenesulfonate Openeye Name: (5-bromo-1H-indol-7-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (5-bromo-1H-indol-7-yl) ester IUPAC Name: (5-bromo-1H-indol-7-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (5-bromo-1H-indol-7-yl) ester Formula: C15H12BrNO3S MolecularWeight: 366.22968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)Br)C=CN3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C3C(=CC(=C2)Br)C=CN3

InChI

InChI=1S/C15H12BrNO3S/c1-10-2-4-13(5-3-10)21(18,19)20-14-9-12(16)8-11-6-7-17-15(11)14/h2-9,17H,1H3