methyl 2-[4-(phenylsulfonyl)but-2-ynoxymethyl]prop-2-enoate

Systemtic Name: methyl 2-[4-(phenylsulfonyl)but-2-ynoxymethyl]prop-2-enoate Openeye Name: methyl 2-[4-(benzenesulfonyl)but-2-ynoxymethyl]prop-2-enoate CAS Name: 2-[4-(benzenesulfonyl)but-2-ynoxymethyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[4-(benzenesulfonyl)but-2-ynoxymethyl]prop-2-enoate Traditional Name: 2-(4-besylbut-2-ynoxymethyl)acrylic acid methyl ester Formula: C15H16O5S MolecularWeight: 308.34954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)COCC#CCS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)C(=C)COCC#CCS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H16O5S/c1-13(15(16)19-2)12-20-10-6-7-11-21(17,18)14-8-4-3-5-9-14/h3-5,8-9H,1,10-12H2,2H3