[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C28H38N2O5S MolecularWeight: 514.67672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O5S/c1-27(2,3)21-15-20(16-22(17-21)28(4,5)6)26(32)35-19-25(31)29-23-11-10-12-24(18-23)36(33,34)30-13-8-7-9-14-30/h10-12,15-18H,7-9,13-14,19H2,1-6H3,(H,29,31)