ethyl 3-[2-methylsulfonyloxybutanoyl-(phenylmethyl)amino]-4-(phenylcarbonyl)benzoate

Systemtic Name: ethyl 3-[2-methylsulfonyloxybutanoyl-(phenylmethyl)amino]-4-(phenylcarbonyl)benzoate Openeye Name: ethyl 4-benzoyl-3-[benzyl(2-methylsulfonyloxybutanoyl)amino]benzoate CAS Name: 4-benzoyl-3-[(2-methylsulfonyloxy-1-oxobutyl)-(phenylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-3-[benzyl(2-methylsulfonyloxybutanoyl)amino]benzoate Traditional Name: 4-benzoyl-3-[benzyl(2-methylsulfonyloxybutanoyl)amino]benzoic acid ethyl ester Formula: C28H29NO7S MolecularWeight: 523.59736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)OCC)C(=O)C3=CC=CC=C3)OS(=O)(=O)C

Isomeric SMILES

CCC(C(=O)N(CC1=CC=CC=C1)C2=C(C=CC(=C2)C(=O)OCC)C(=O)C3=CC=CC=C3)OS(=O)(=O)C

InChI

InChI=1S/C28H29NO7S/c1-4-25(36-37(3,33)34)27(31)29(19-20-12-8-6-9-13-20)24-18-22(28(32)35-5-2)16-17-23(24)26(30)21-14-10-7-11-15-21/h6-18,25H,4-5,19H2,1-3H3