(E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonyl-aziridin-2-yl]prop-2-enamide

Systemtic Name: (E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonyl-aziridin-2-yl]prop-2-enamide Openeye Name: (E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonyl-aziridin-2-yl]prop-2-enamide CAS Name: (E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonyl-2-aziridinyl]-2-propenamide IUPAC Name: (E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonylaziridin-2-yl]prop-2-enamide Traditional Name: (E)-N-methyl-3-[(2R,3S)-3-methyl-1-(2-nitrophenyl)sulfonyl-ethylenimin-2-yl]acrylamide Formula: C13H15N3O5S MolecularWeight: 325.3403

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C=CC(=O)NC

Isomeric SMILES

C[C@H]1[C@H](N1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])/C=C/C(=O)NC

InChI

InChI=1S/C13H15N3O5S/c1-9-10(7-8-13(17)14-2)15(9)22(20,21)12-6-4-3-5-11(12)16(18)19/h3-10H,1-2H3,(H,14,17)/b8-7+/t9-,10+,15?/m0/s1