3-(hydroxymethyl)-3-(6-oxidanyl-1,3-benzodioxol-5-yl)-1-pentyl-pyrrolo[3,2-b]pyridin-2-one

Systemtic Name: 3-(hydroxymethyl)-3-(6-oxidanyl-1,3-benzodioxol-5-yl)-1-pentyl-pyrrolo[3,2-b]pyridin-2-one Openeye Name: 3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-(hydroxymethyl)-1-pentyl-pyrrolo[3,2-b]pyridin-2-one CAS Name: 3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-(hydroxymethyl)-1-pentyl-2-pyrrolo[3,2-b]pyridinone IUPAC Name: 3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-(hydroxymethyl)-1-pentylpyrrolo[3,2-b]pyridin-2-one Traditional Name: 1-amyl-3-(6-hydroxy-1,3-benzodioxol-5-yl)-3-methylol-pyrrolo[3,2-b]pyridin-2-one Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C(C1=O)(CO)C3=CC4=C(C=C3O)OCO4)N=CC=C2

Isomeric SMILES

CCCCCN1C2=C(C(C1=O)(CO)C3=CC4=C(C=C3O)OCO4)N=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-2-3-4-8-22-14-6-5-7-21-18(14)20(11-23,19(22)25)13-9-16-17(10-15(13)24)27-12-26-16/h5-7,9-10,23-24H,2-4,8,11-12H2,1H3