methyl 4-[(3,5-ditert-butyl-2-oxidanyl-phenyl)-piperidin-1-yl-methyl]benzoate

Systemtic Name: methyl 4-[(3,5-ditert-butyl-2-oxidanyl-phenyl)-piperidin-1-yl-methyl]benzoate Openeye Name: methyl 4-[(3,5-ditert-butyl-2-hydroxy-phenyl)-(1-piperidyl)methyl]benzoate CAS Name: 4-[(3,5-ditert-butyl-2-hydroxyphenyl)-(1-piperidinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,5-ditert-butyl-2-hydroxyphenyl)-piperidin-1-ylmethyl]benzoate Traditional Name: 4-[(3,5-ditert-butyl-2-hydroxy-phenyl)-piperidino-methyl]benzoic acid methyl ester Formula: C28H39NO3 MolecularWeight: 437.61416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C2=CC=C(C=C2)C(=O)OC)N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C2=CC=C(C=C2)C(=O)OC)N3CCCCC3

InChI

InChI=1S/C28H39NO3/c1-27(2,3)21-17-22(25(30)23(18-21)28(4,5)6)24(29-15-9-8-10-16-29)19-11-13-20(14-12-19)26(31)32-7/h11-14,17-18,24,30H,8-10,15-16H2,1-7H3