1-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(phenylmethyl)pyrrol-3-yl]ethanone

Systemtic Name: 1-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-(phenylmethyl)pyrrol-3-yl]ethanone Openeye Name: 1-[1-benzyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrol-3-yl]ethanone CAS Name: 1-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(phenylmethyl)-3-pyrrolyl]ethanone IUPAC Name: 1-[1-benzyl-2-(3,5-ditert-butyl-4-hydroxyphenyl)pyrrol-3-yl]ethanone Traditional Name: 1-[1-benzyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)pyrrol-3-yl]ethanone Formula: C27H33NO2 MolecularWeight: 403.55642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C=C1)CC2=CC=CC=C2)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(=O)C1=C(N(C=C1)CC2=CC=CC=C2)C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C27H33NO2/c1-18(29)21-13-14-28(17-19-11-9-8-10-12-19)24(21)20-15-22(26(2,3)4)25(30)23(16-20)27(5,6)7/h8-16,30H,17H2,1-7H3