methyl 4-[(E)-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]hydrazono]methyl]benzoate CAS Name: 4-[(E)-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[(1-tosylprolyl)hydrazono]methyl]benzoic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NN=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H23N3O5S/c1-15-5-11-18(12-6-15)30(27,28)24-13-3-4-19(24)20(25)23-22-14-16-7-9-17(10-8-16)21(26)29-2/h5-12,14,19H,3-4,13H2,1-2H3,(H,23,25)/b22-14+