methyl 1-[2-[[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-4-nitro-phenyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-[[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-4-nitro-phenyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[4-nitro-2-[(p-tolylsulfonylhydrazono)methyl]phenyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-4-nitrophenyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[[(4-methylphenyl)sulfonylhydrazinylidene]methyl]-4-nitrophenyl]pyrrolidine-2-carboxylate Traditional Name: 1-[4-nitro-2-[(tosylhydrazono)methyl]phenyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H22N4O6S MolecularWeight: 446.47688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3C(=O)OC

InChI

InChI=1S/C20H22N4O6S/c1-14-5-8-17(9-6-14)31(28,29)22-21-13-15-12-16(24(26)27)7-10-18(15)23-11-3-4-19(23)20(25)30-2/h5-10,12-13,19,22H,3-4,11H2,1-2H3