methyl (2S)-4-(2,2-dimethylpropoxysulfonyl)-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: methyl (2S)-4-(2,2-dimethylpropoxysulfonyl)-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: methyl (2S)-2-(benzyloxycarbonylamino)-4-(2,2-dimethylpropoxysulfonyl)butanoate CAS Name: (2S)-4-(2,2-dimethylpropoxysulfonyl)-2-(phenylmethoxycarbonylamino)butanoic acid methyl ester IUPAC Name: methyl (2S)-4-(2,2-dimethylpropoxysulfonyl)-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-4-neopentyloxysulfonyl-butyric acid methyl ester Formula: C18H27NO7S MolecularWeight: 401.47448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COS(=O)(=O)CCC(C(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)COS(=O)(=O)CC[C@@H](C(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H27NO7S/c1-18(2,3)13-26-27(22,23)11-10-15(16(20)24-4)19-17(21)25-12-14-8-6-5-7-9-14/h5-9,15H,10-13H2,1-4H3,(H,19,21)/t15-/m0/s1