methyl (2S)-2-[[(2R)-3-methyl-3-oxidanyl-2-(phenylsulfonylamino)butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-3-methyl-3-oxidanyl-2-(phenylsulfonylamino)butanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(2R)-2-(benzenesulfonamido)-3-hydroxy-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2R)-2-(benzenesulfonamido)-3-hydroxy-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-(benzenesulfonamido)-3-hydroxy-3-methylbutanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2R)-2-(benzenesulfonamido)-3-hydroxy-3-methyl-butanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6S/c1-21(2,26)18(23-30(27,28)16-12-8-5-9-13-16)19(24)22-17(20(25)29-3)14-15-10-6-4-7-11-15/h4-13,17-18,23,26H,14H2,1-3H3,(H,22,24)/t17-,18-/m0/s1