1-(1,2,4-trimethylpyrrol-3-yl)octadecan-1-one

Systemtic Name: 1-(1,2,4-trimethylpyrrol-3-yl)octadecan-1-one Openeye Name: 1-(1,2,4-trimethylpyrrol-3-yl)octadecan-1-one CAS Name: 1-(1,2,4-trimethyl-3-pyrrolyl)-1-octadecanone IUPAC Name: 1-(1,2,4-trimethylpyrrol-3-yl)octadecan-1-one Traditional Name: 1-(1,2,4-trimethylpyrrol-3-yl)octadecan-1-one Formula: C25H45NO MolecularWeight: 375.6309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)C)C

InChI

InChI=1S/C25H45NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(27)25-22(2)21-26(4)23(25)3/h21H,5-20H2,1-4H3