3,3-bis(bromanyl)-5-methoxy-7-(3-phenylmethoxypropyl)-1H-pyrrolo[3,2-b]pyridin-2-one

Systemtic Name: 3,3-bis(bromanyl)-5-methoxy-7-(3-phenylmethoxypropyl)-1H-pyrrolo[3,2-b]pyridin-2-one Openeye Name: 7-(3-benzyloxypropyl)-3,3-dibromo-5-methoxy-1H-pyrrolo[3,2-b]pyridin-2-one CAS Name: 3,3-dibromo-5-methoxy-7-(3-phenylmethoxypropyl)-1H-pyrrolo[3,2-b]pyridin-2-one IUPAC Name: 3,3-dibromo-5-methoxy-7-(3-phenylmethoxypropyl)-1H-pyrrolo[3,2-b]pyridin-2-one Traditional Name: 7-(3-benzoxypropyl)-3,3-dibromo-5-methoxy-1H-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)CCCOCC3=CC=CC=C3)NC(=O)C2(Br)Br

Isomeric SMILES

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

InChI

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