methyl (2S)-2-[[(2R)-2-(methylsulfonylamino)-3-phenylmethoxy-propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-2-(methylsulfonylamino)-3-phenylmethoxy-propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(2R)-3-benzyloxy-2-(methanesulfonamido)propanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2R)-2-(methanesulfonamido)-1-oxo-3-phenylmethoxypropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-(methanesulfonamido)-3-phenylmethoxypropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2R)-3-benzoxy-2-(methanesulfonamido)propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(COCC2=CC=CC=C2)NS(=O)(=O)C

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](COCC2=CC=CC=C2)NS(=O)(=O)C

InChI

InChI=1S/C21H26N2O6S/c1-28-21(25)18(13-16-9-5-3-6-10-16)22-20(24)19(23-30(2,26)27)15-29-14-17-11-7-4-8-12-17/h3-12,18-19,23H,13-15H2,1-2H3,(H,22,24)/t18-,19+/m0/s1