(phenylmethyl) (2R)-2-methyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-2-methyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carboxylate Openeye Name: benzyl (2R)-2-methyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carboxylate CAS Name: (2R)-2-methyl-4-(2-nitrophenyl)sulfonyl-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-methyl-4-(2-nitrophenyl)sulfonylpiperazine-1-carboxylate Traditional Name: (2R)-2-methyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carboxylic acid benzyl ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-15-13-20(29(26,27)18-10-6-5-9-17(18)22(24)25)11-12-21(15)19(23)28-14-16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3/t15-/m1/s1