methyl 3-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethoxy]benzoate

Systemtic Name: methyl 3-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethoxy]benzoate Openeye Name: methyl 3-[2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethoxy]benzoate CAS Name: 3-[2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethoxy]benzoate Traditional Name: 3-[2-keto-2-(3-piperidinosulfonylanilino)ethoxy]benzoic acid methyl ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

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