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The molecular formula of the compound is C18H31N.
The molecular weight of the compound is 261.4 g/mol.
The IUPAC name of the compound is 2-[(E)-but-1-enyl]-5-methyl-2,3,4-tripropylpyrrole.
The InChI of the compound is InChI=1S/C18H31N/c1-6-10-14-18(13-9-4)17(12-8-3)16(11-7-2)15(5)19-18/h10,14H,6-9,11-13H2,1-5H3/b14-10+.
The InChIKey of the compound is XGLPLQVGERADKH-GXDHUFHOSA-N.
The Canonical SMILES of the compound is CCCC1=C(C(N=C1C)(CCC)C=CCC)CCC.
The Isomeric SMILES of the compound is CCCC1=C(C(N=C1C)(CCC)/C=C/CC)CCC.
The XLogP3-AA value of the compound is 5.
The compound has 8 rotatable bonds.
Yes, the compound is canonicalized according to PubChem.
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