3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-pyrrol-1-yl-propan-1-one

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1-pyrrol-1-yl-propan-1-one Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-pyrrol-1-yl-propan-1-one CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-(1-pyrrolyl)-1-propanone IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-pyrrol-1-ylpropan-1-one Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)-1-pyrrol-1-yl-propan-1-one Formula: C21H29NO2 MolecularWeight: 327.46046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2C=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2C=CC=C2

InChI

InChI=1S/C21H29NO2/c1-20(2,3)16-13-15(14-17(19(16)24)21(4,5)6)9-10-18(23)22-11-7-8-12-22/h7-8,11-14,24H,9-10H2,1-6H3