1-(4-octyl-1H-pyrrol-3-yl)octan-1-one

Systemtic Name: 1-(4-octyl-1H-pyrrol-3-yl)octan-1-one Openeye Name: 1-(4-octyl-1H-pyrrol-3-yl)octan-1-one CAS Name: 1-(4-octyl-1H-pyrrol-3-yl)-1-octanone IUPAC Name: 1-(4-octyl-1H-pyrrol-3-yl)octan-1-one Traditional Name: 1-(4-octyl-1H-pyrrol-3-yl)octan-1-one Formula: C20H35NO MolecularWeight: 305.498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CNC=C1C(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCC1=CNC=C1C(=O)CCCCCCC

InChI

InChI=1S/C20H35NO/c1-3-5-7-9-11-12-14-18-16-21-17-19(18)20(22)15-13-10-8-6-4-2/h16-17,21H,3-15H2,1-2H3