2-[(4-methoxycarbonylphenyl)methyl]-4-methyl-benzenesulfonate

Systemtic Name: 2-[(4-methoxycarbonylphenyl)methyl]-4-methyl-benzenesulfonate Openeye Name: 2-[(4-methoxycarbonylphenyl)methyl]-4-methyl-benzenesulfonate CAS Name: 2-[(4-methoxycarbonylphenyl)methyl]-4-methylbenzenesulfonate IUPAC Name: 2-[(4-methoxycarbonylphenyl)methyl]-4-methylbenzenesulfonate Traditional Name: 2-(4-carbomethoxybenzyl)-4-methyl-besylate Formula: C16H15O5S- MolecularWeight: 319.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H16O5S/c1-11-3-8-15(22(18,19)20)14(9-11)10-12-4-6-13(7-5-12)16(17)21-2/h3-9H,10H2,1-2H3,(H,18,19,20)/p-1