1-[1-(phenylmethyl)pyrrolo[2,3-b]pyridin-3-yl]octan-3-one

Systemtic Name: 1-[1-(phenylmethyl)pyrrolo[2,3-b]pyridin-3-yl]octan-3-one Openeye Name: 1-(1-benzylpyrrolo[2,3-b]pyridin-3-yl)octan-3-one CAS Name: 1-[1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinyl]-3-octanone IUPAC Name: 1-(1-benzylpyrrolo[2,3-b]pyridin-3-yl)octan-3-one Traditional Name: 1-(1-benzylpyrrolo[2,3-b]pyridin-3-yl)octan-3-one Formula: C22H26N2O MolecularWeight: 334.45464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CCC1=CN(C2=C1C=CC=N2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)CCC1=CN(C2=C1C=CC=N2)CC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O/c1-2-3-5-11-20(25)14-13-19-17-24(16-18-9-6-4-7-10-18)22-21(19)12-8-15-23-22/h4,6-10,12,15,17H,2-3,5,11,13-14,16H2,1H3