methyl 4-[[2-[methylsulfonyl(phenethyl)amino]ethanoylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[[2-[methylsulfonyl(phenethyl)amino]ethanoylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[[[2-[methylsulfonyl(phenethyl)amino]acetyl]hydrazono]methyl]benzoate CAS Name: 4-[[[2-[methylsulfonyl(phenethyl)amino]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[methylsulfonyl(phenethyl)amino]acetyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[[[2-[mesyl(phenethyl)amino]acetyl]hydrazono]methyl]benzoic acid methyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H23N3O5S/c1-28-20(25)18-10-8-17(9-11-18)14-21-22-19(24)15-23(29(2,26)27)13-12-16-6-4-3-5-7-16/h3-11,14H,12-13,15H2,1-2H3,(H,22,24)