3,3-bis(bromanyl)-5-methoxy-1-(3-phenylmethoxypropyl)pyrrolo[3,2-b]pyridin-2-one

Systemtic Name: 3,3-bis(bromanyl)-5-methoxy-1-(3-phenylmethoxypropyl)pyrrolo[3,2-b]pyridin-2-one Openeye Name: 1-(3-benzyloxypropyl)-3,3-dibromo-5-methoxy-pyrrolo[3,2-b]pyridin-2-one CAS Name: 3,3-dibromo-5-methoxy-1-(3-phenylmethoxypropyl)-2-pyrrolo[3,2-b]pyridinone IUPAC Name: 3,3-dibromo-5-methoxy-1-(3-phenylmethoxypropyl)pyrrolo[3,2-b]pyridin-2-one Traditional Name: 1-(3-benzoxypropyl)-3,3-dibromo-5-methoxy-pyrrolo[3,2-b]pyridin-2-one Formula: C18H18Br2N2O3 MolecularWeight: 470.15512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=C1)N(C(=O)C2(Br)Br)CCCOCC3=CC=CC=C3

Isomeric SMILES

COC1=NC2=C(C=C1)N(C(=O)C2(Br)Br)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C18H18Br2N2O3/c1-24-15-9-8-14-16(21-15)18(19,20)17(23)22(14)10-5-11-25-12-13-6-3-2-4-7-13/h2-4,6-9H,5,10-12H2,1H3