(3-methoxycarbonylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate Openeye Name: (3-methoxycarbonylphenyl)methyl 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid (3-carbomethoxybenzyl) ester Formula: C18H18O6S MolecularWeight: 362.39692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OCC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C18H18O6S/c1-12-7-8-15(25(3,21)22)10-16(12)18(20)24-11-13-5-4-6-14(9-13)17(19)23-2/h4-10H,11H2,1-3H3