O1-tert-butyl O5-methyl (2R)-2-[(2-nitro-4-phenylmethoxy-phenyl)sulfonylamino]pentanedioate

Systemtic Name: O1-tert-butyl O5-methyl (2R)-2-[(2-nitro-4-phenylmethoxy-phenyl)sulfonylamino]pentanedioate Openeye Name: O1-tert-butyl O5-methyl (2R)-2-[(4-benzyloxy-2-nitro-phenyl)sulfonylamino]pentanedioate CAS Name: (2R)-2-[(2-nitro-4-phenylmethoxyphenyl)sulfonylamino]pentanedioic acid O1-tert-butyl ester O5-methyl ester IUPAC Name: 1-O-tert-butyl 5-O-methyl (2R)-2-[(2-nitro-4-phenylmethoxyphenyl)sulfonylamino]pentanedioate Traditional Name: (2R)-2-[(4-benzoxy-2-nitro-phenyl)sulfonylamino]glutaric acid O1-tert-butyl ester O5-methyl ester Formula: C23H28N2O9S MolecularWeight: 508.54142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](CCC(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C23H28N2O9S/c1-23(2,3)34-22(27)18(11-13-21(26)32-4)24-35(30,31)20-12-10-17(14-19(20)25(28)29)33-15-16-8-6-5-7-9-16/h5-10,12,14,18,24H,11,13,15H2,1-4H3/t18-/m1/s1