1-(1-heptyl-2,4-dimethyl-pyrrol-3-yl)octadecan-1-one

Systemtic Name: 1-(1-heptyl-2,4-dimethyl-pyrrol-3-yl)octadecan-1-one Openeye Name: 1-(1-heptyl-2,4-dimethyl-pyrrol-3-yl)octadecan-1-one CAS Name: 1-(1-heptyl-2,4-dimethyl-3-pyrrolyl)-1-octadecanone IUPAC Name: 1-(1-heptyl-2,4-dimethylpyrrol-3-yl)octadecan-1-one Traditional Name: 1-(1-heptyl-2,4-dimethyl-pyrrol-3-yl)octadecan-1-one Formula: C31H57NO MolecularWeight: 459.79038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H57NO/c1-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-30(33)31-28(3)27-32(29(31)4)26-24-22-10-8-6-2/h27H,5-26H2,1-4H3