4-[5-(3-oxidanylidenebutyl)-1H-pyrrol-2-yl]butan-2-one

Systemtic Name: 4-[5-(3-oxidanylidenebutyl)-1H-pyrrol-2-yl]butan-2-one Openeye Name: 4-[5-(3-oxobutyl)-1H-pyrrol-2-yl]butan-2-one CAS Name: 4-[5-(3-oxobutyl)-1H-pyrrol-2-yl]-2-butanone IUPAC Name: 4-[5-(3-oxobutyl)-1H-pyrrol-2-yl]butan-2-one Traditional Name: 4-[5-(3-ketobutyl)-1H-pyrrol-2-yl]butan-2-one Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(N1)CCC(=O)C

Isomeric SMILES

CC(=O)CCC1=CC=C(N1)CCC(=O)C

InChI

InChI=1S/C12H17NO2/c1-9(14)3-5-11-7-8-12(13-11)6-4-10(2)15/h7-8,13H,3-6H2,1-2H3