4-[(Z)-[[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylhydrazinylidene]methyl]benzoate

Systemtic Name: 4-[(Z)-[[(3R)-1-(4-methylphenyl)sulfonylpiperidin-3-yl]carbonylhydrazinylidene]methyl]benzoate Openeye Name: 4-[(Z)-[[(3R)-1-(p-tolylsulfonyl)piperidine-3-carbonyl]hydrazono]methyl]benzoate CAS Name: 4-[(Z)-[[[(3R)-1-(4-methylphenyl)sulfonyl-3-piperidinyl]-oxomethyl]hydrazinylidene]methyl]benzoate IUPAC Name: 4-[(Z)-[[(3R)-1-(4-methylphenyl)sulfonylpiperidine-3-carbonyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(Z)-[[(3R)-1-tosylnipecotoyl]hydrazono]methyl]benzoate Formula: C21H22N3O5S- MolecularWeight: 428.48148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NN=CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N/N=C\C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C21H23N3O5S/c1-15-4-10-19(11-5-15)30(28,29)24-12-2-3-18(14-24)20(25)23-22-13-16-6-8-17(9-7-16)21(26)27/h4-11,13,18H,2-3,12,14H2,1H3,(H,23,25)(H,26,27)/p-1/b22-13-/t18-/m1/s1