methyl (3S,4S)-2,2-dimethyl-3-oxidanyl-4-phenyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]butanoate

Systemtic Name: methyl (3S,4S)-2,2-dimethyl-3-oxidanyl-4-phenyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]butanoate Openeye Name: methyl (3S,4S)-3-hydroxy-2,2-dimethyl-4-phenyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]butanoate CAS Name: (3S,4S)-3-hydroxy-2,2-dimethyl-4-phenyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl (3S,4S)-3-hydroxy-2,2-dimethyl-4-phenyl-4-[(2,4,6-trimethylphenyl)sulfonylamino]butanoate Traditional Name: (3S,4S)-3-hydroxy-4-(mesitylsulfonylamino)-2,2-dimethyl-4-phenyl-butyric acid methyl ester Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@@H](C2=CC=CC=C2)[C@H](C(C)(C)C(=O)OC)O)C

InChI

InChI=1S/C22H29NO5S/c1-14-12-15(2)19(16(3)13-14)29(26,27)23-18(17-10-8-7-9-11-17)20(24)22(4,5)21(25)28-6/h7-13,18,20,23-24H,1-6H3/t18-,20+/m0/s1