tert-butyl (2S)-2-[(2-ethoxy-2-oxidanylidene-ethyl)-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[(2-ethoxy-2-oxidanylidene-ethyl)-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[(2-ethoxy-2-oxo-ethyl)-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoate CAS Name: (2S)-2-[(2-ethoxy-2-oxoethyl)-(4-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(2-ethoxy-2-oxoethyl)-(4-nitrophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2-ethoxy-2-keto-ethyl)-nosyl-amino]-3-phenyl-propionic acid tert-butyl ester Formula: C23H28N2O8S MolecularWeight: 492.54202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(CC1=CC=CC=C1)C(=O)OC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O8S/c1-5-32-21(26)16-24(34(30,31)19-13-11-18(12-14-19)25(28)29)20(22(27)33-23(2,3)4)15-17-9-7-6-8-10-17/h6-14,20H,5,15-16H2,1-4H3/t20-/m0/s1