[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O3/c1-27(2,3)21-16-20(17-22(18-21)28(4,5)6)26(32)33-19-25(31)29-23-10-12-24(13-11-23)30-14-8-7-9-15-30/h10-13,16-18H,7-9,14-15,19H2,1-6H3,(H,29,31)