1-(phenylsulfonyl)hept-2-ynylbenzene

Systemtic Name: 1-(phenylsulfonyl)hept-2-ynylbenzene Openeye Name: 1-(benzenesulfonyl)hept-2-ynylbenzene CAS Name: 1-(benzenesulfonyl)hept-2-ynylbenzene IUPAC Name: 1-(benzenesulfonyl)hept-2-ynylbenzene Traditional Name: 1-besylhept-2-ynylbenzene Formula: C19H20O2S MolecularWeight: 312.4259

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC#CC(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20O2S/c1-2-3-4-11-16-19(17-12-7-5-8-13-17)22(20,21)18-14-9-6-10-15-18/h5-10,12-15,19H,2-4H2,1H3