methyl (3S)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]-4-phenyl-butanoate

Systemtic Name: methyl (3S)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]-4-phenyl-butanoate Openeye Name: methyl (3S)-3-[methyl-(4-nitrophenyl)sulfonyl-amino]-4-phenyl-butanoate CAS Name: (3S)-3-[methyl-(4-nitrophenyl)sulfonylamino]-4-phenylbutanoic acid methyl ester IUPAC Name: methyl (3S)-3-[methyl-(4-nitrophenyl)sulfonylamino]-4-phenylbutanoate Traditional Name: (3S)-3-[methyl(nosyl)amino]-4-phenyl-butyric acid methyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O6S/c1-19(27(24,25)17-10-8-15(9-11-17)20(22)23)16(13-18(21)26-2)12-14-6-4-3-5-7-14/h3-11,16H,12-13H2,1-2H3/t16-/m0/s1