[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 3-piperidin-1-ylsulfonylbenzoate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (2-keto-2-mesidino-ethyl) ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C23H28N2O5S/c1-16-12-17(2)22(18(3)13-16)24-21(26)15-30-23(27)19-8-7-9-20(14-19)31(28,29)25-10-5-4-6-11-25/h7-9,12-14H,4-6,10-11,15H2,1-3H3,(H,24,26)