[2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-(4-hydroxyanilino)-2-oxo-ethyl] 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid [2-(4-hydroxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-hydroxyanilino)-2-oxoethyl] 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid [2-(4-hydroxyanilino)-2-keto-ethyl] ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC(=O)NC3=CC=C(C=C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OCC(=O)NC3=CC=C(C=C3)O

InChI

InChI=1S/C21H24N2O6S/c1-15-5-10-18(30(27,28)23-11-3-2-4-12-23)13-19(15)21(26)29-14-20(25)22-16-6-8-17(24)9-7-16/h5-10,13,24H,2-4,11-12,14H2,1H3,(H,22,25)