(1R,2S)-2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide

Systemtic Name: (1R,2S)-2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]cyclopropane-1-carboxamide Openeye Name: (1R,2S)-2-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]cyclopropanecarboxamide CAS Name: (1R,2S)-2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-1-cyclopropanecarboxamide IUPAC Name: (1R,2S)-2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]cyclopropane-1-carboxamide Traditional Name: (1R,2S)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-methyl-cyclopropanecarboxamide Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1C[C@H]1C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-9-7-11(9)14(18)16-6-5-15-12-4-3-10(23(2,21)22)8-13(12)17(19)20/h3-4,8-9,11,15H,5-7H2,1-2H3,(H,16,18)/t9-,11+/m0/s1