1-(4-heptyl-1H-pyrrol-3-yl)heptan-1-one

Systemtic Name: 1-(4-heptyl-1H-pyrrol-3-yl)heptan-1-one Openeye Name: 1-(4-heptyl-1H-pyrrol-3-yl)heptan-1-one CAS Name: 1-(4-heptyl-1H-pyrrol-3-yl)-1-heptanone IUPAC Name: 1-(4-heptyl-1H-pyrrol-3-yl)heptan-1-one Traditional Name: 1-(4-heptyl-1H-pyrrol-3-yl)heptan-1-one Formula: C18H31NO MolecularWeight: 277.44484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CNC=C1C(=O)CCCCCC

Isomeric SMILES

CCCCCCCC1=CNC=C1C(=O)CCCCCC

InChI

InChI=1S/C18H31NO/c1-3-5-7-9-10-12-16-14-19-15-17(16)18(20)13-11-8-6-4-2/h14-15,19H,3-13H2,1-2H3