1-[4-(1H-pyrrol-2-ylmethyl)phenyl]pentan-1-one

Systemtic Name: 1-[4-(1H-pyrrol-2-ylmethyl)phenyl]pentan-1-one Openeye Name: 1-[4-(1H-pyrrol-2-ylmethyl)phenyl]pentan-1-one CAS Name: 1-[4-(1H-pyrrol-2-ylmethyl)phenyl]-1-pentanone IUPAC Name: 1-[4-(1H-pyrrol-2-ylmethyl)phenyl]pentan-1-one Traditional Name: 1-[4-(1H-pyrrol-2-ylmethyl)phenyl]pentan-1-one Formula: C16H19NO MolecularWeight: 241.32816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC=C(C=C1)CC2=CC=CN2

Isomeric SMILES

CCCCC(=O)C1=CC=C(C=C1)CC2=CC=CN2

InChI

InChI=1S/C16H19NO/c1-2-3-6-16(18)14-9-7-13(8-10-14)12-15-5-4-11-17-15/h4-5,7-11,17H,2-3,6,12H2,1H3