methyl (2S)-3-methyl-2-[[(2R)-2-[(4-nitrophenyl)sulfonylamino]propanoyl]amino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[(2R)-2-[(4-nitrophenyl)sulfonylamino]propanoyl]amino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[[(2R)-2-[(4-nitrophenyl)sulfonylamino]propanoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2R)-2-[(4-nitrophenyl)sulfonylamino]-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[(2R)-2-[(4-nitrophenyl)sulfonylamino]propanoyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[(2R)-2-(nosylamino)propanoyl]amino]butyric acid methyl ester Formula: C15H21N3O7S MolecularWeight: 387.40814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C(C)NS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O7S/c1-9(2)13(15(20)25-4)16-14(19)10(3)17-26(23,24)12-7-5-11(6-8-12)18(21)22/h5-10,13,17H,1-4H3,(H,16,19)/t10-,13+/m1/s1