methyl 3-methyl-5-phenyl-2-(phenylsulfonyl)pentanoate

Systemtic Name: methyl 3-methyl-5-phenyl-2-(phenylsulfonyl)pentanoate Openeye Name: methyl 2-(benzenesulfonyl)-3-methyl-5-phenyl-pentanoate CAS Name: 2-(benzenesulfonyl)-3-methyl-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-(benzenesulfonyl)-3-methyl-5-phenylpentanoate Traditional Name: 2-besyl-3-methyl-5-phenyl-valeric acid methyl ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)C(C(=O)OC)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CCC1=CC=CC=C1)C(C(=O)OC)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H22O4S/c1-15(13-14-16-9-5-3-6-10-16)18(19(20)23-2)24(21,22)17-11-7-4-8-12-17/h3-12,15,18H,13-14H2,1-2H3