5-(phenylsulfonyl)pentanoate

Systemtic Name: 5-(phenylsulfonyl)pentanoate Openeye Name: 5-(benzenesulfonyl)pentanoate CAS Name: 5-(benzenesulfonyl)pentanoate IUPAC Name: 5-(benzenesulfonyl)pentanoate Traditional Name: 5-besylvalerate Formula: C11H13O4S- MolecularWeight: 241.28352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCCC(=O)[O-]

InChI

InChI=1S/C11H14O4S/c12-11(13)8-4-5-9-16(14,15)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13)/p-1