(3-cyanophenyl) 2,3-dihydro-1H-indene-5-sulfonate

Systemtic Name: (3-cyanophenyl) 2,3-dihydro-1H-indene-5-sulfonate Openeye Name: (3-cyanophenyl) indane-5-sulfonate CAS Name: 2,3-dihydro-1H-indene-5-sulfonic acid (3-cyanophenyl) ester IUPAC Name: (3-cyanophenyl) 2,3-dihydro-1H-indene-5-sulfonate Traditional Name: indane-5-sulfonic acid (3-cyanophenyl) ester Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)OC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)OC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H13NO3S/c17-11-12-3-1-6-15(9-12)20-21(18,19)16-8-7-13-4-2-5-14(13)10-16/h1,3,6-10H,2,4-5H2