methyl 2-formamido-2-[4-(2-methylphenyl)phenyl]carbonyl-4-methylsulfonyl-butanoate

Systemtic Name: methyl 2-formamido-2-[4-(2-methylphenyl)phenyl]carbonyl-4-methylsulfonyl-butanoate Openeye Name: methyl 2-formamido-4-methylsulfonyl-2-[4-(o-tolyl)benzoyl]butanoate CAS Name: 2-formamido-2-[[4-(2-methylphenyl)phenyl]-oxomethyl]-4-methylsulfonylbutanoic acid methyl ester IUPAC Name: methyl 2-formamido-2-[4-(2-methylphenyl)benzoyl]-4-methylsulfonylbutanoate Traditional Name: 2-formamido-4-mesyl-2-[4-(o-tolyl)benzoyl]butyric acid methyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC=C(C=C2)C(=O)C(CCS(=O)(=O)C)(C(=O)OC)NC=O

Isomeric SMILES

CC1=CC=CC=C1C2=CC=C(C=C2)C(=O)C(CCS(=O)(=O)C)(C(=O)OC)NC=O

InChI

InChI=1S/C21H23NO6S/c1-15-6-4-5-7-18(15)16-8-10-17(11-9-16)19(24)21(22-14-23,20(25)28-2)12-13-29(3,26)27/h4-11,14H,12-13H2,1-3H3,(H,22,23)