4-[3-(5-bromanyl-1H-pyrrol-3-yl)propyl]-2,6-ditert-butyl-phenol

Systemtic Name: 4-[3-(5-bromanyl-1H-pyrrol-3-yl)propyl]-2,6-ditert-butyl-phenol Openeye Name: 4-[3-(5-bromo-1H-pyrrol-3-yl)propyl]-2,6-ditert-butyl-phenol CAS Name: 4-[3-(5-bromo-1H-pyrrol-3-yl)propyl]-2,6-ditert-butylphenol IUPAC Name: 4-[3-(5-bromo-1H-pyrrol-3-yl)propyl]-2,6-ditert-butylphenol Traditional Name: 4-[3-(5-bromo-1H-pyrrol-3-yl)propyl]-2,6-ditert-butyl-phenol Formula: C21H30BrNO MolecularWeight: 392.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=CNC(=C2)Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCC2=CNC(=C2)Br

InChI

InChI=1S/C21H30BrNO/c1-20(2,3)16-10-14(11-17(19(16)24)21(4,5)6)8-7-9-15-12-18(22)23-13-15/h10-13,23-24H,7-9H2,1-6H3