methyl (2S)-2-[butyl-(2-nitrophenyl)sulfonyl-amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[butyl-(2-nitrophenyl)sulfonyl-amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[butyl-(2-nitrophenyl)sulfonyl-amino]-3-methyl-butanoate CAS Name: (2S)-2-[butyl-(2-nitrophenyl)sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[butyl-(2-nitrophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-2-[butyl-(2-nitrophenyl)sulfonyl-amino]-3-methyl-butyric acid methyl ester Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C(C)C)C(=O)OC)S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O6S/c1-5-6-11-17(15(12(2)3)16(19)24-4)25(22,23)14-10-8-7-9-13(14)18(20)21/h7-10,12,15H,5-6,11H2,1-4H3/t15-/m0/s1