(2S,3R)-N-methoxy-N-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(3-nitrophenyl)-2-oxidanyl-propanamide

Systemtic Name: (2S,3R)-N-methoxy-N-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(3-nitrophenyl)-2-oxidanyl-propanamide Openeye Name: (2S,3R)-2-hydroxy-N-methoxy-N-methyl-3-(3-nitrophenyl)-3-(p-tolylsulfonylamino)propanamide CAS Name: (2S,3R)-2-hydroxy-N-methoxy-N-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(3-nitrophenyl)propanamide IUPAC Name: (2S,3R)-2-hydroxy-N-methoxy-N-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(3-nitrophenyl)propanamide Traditional Name: (2S,3R)-2-hydroxy-N-methoxy-N-methyl-3-(3-nitrophenyl)-3-(tosylamino)propionamide Formula: C18H21N3O7S MolecularWeight: 423.44024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O7S/c1-12-7-9-15(10-8-12)29(26,27)19-16(17(22)18(23)20(2)28-3)13-5-4-6-14(11-13)21(24)25/h4-11,16-17,19,22H,1-3H3/t16-,17+/m1/s1