5-(4-cyanophenyl)pent-4-ynyl methanesulfonate

Systemtic Name: 5-(4-cyanophenyl)pent-4-ynyl methanesulfonate Openeye Name: 5-(4-cyanophenyl)pent-4-ynyl methanesulfonate CAS Name: methanesulfonic acid 5-(4-cyanophenyl)pent-4-ynyl ester IUPAC Name: 5-(4-cyanophenyl)pent-4-ynyl methanesulfonate Traditional Name: methanesulfonic acid 5-(4-cyanophenyl)pent-4-ynyl ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCC#CC1=CC=C(C=C1)C#N

Isomeric SMILES

CS(=O)(=O)OCCCC#CC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H13NO3S/c1-18(15,16)17-10-4-2-3-5-12-6-8-13(11-14)9-7-12/h6-9H,2,4,10H2,1H3