2-[2-iodanyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridin-3-yl]ethyl ethanoate

Systemtic Name: 2-[2-iodanyl-1-(phenylmethyl)pyrrolo[2,3-b]pyridin-3-yl]ethyl ethanoate Openeye Name: 2-(1-benzyl-2-iodo-pyrrolo[2,3-b]pyridin-3-yl)ethyl acetate CAS Name: acetic acid 2-[2-iodo-1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinyl]ethyl ester IUPAC Name: 2-(1-benzyl-2-iodopyrrolo[2,3-b]pyridin-3-yl)ethyl acetate Traditional Name: acetic acid 2-(1-benzyl-2-iodo-pyrrolo[2,3-b]pyridin-3-yl)ethyl ester Formula: C18H17IN2O2 MolecularWeight: 420.24425

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=C(N(C2=C1C=CC=N2)CC3=CC=CC=C3)I

Isomeric SMILES

CC(=O)OCCC1=C(N(C2=C1C=CC=N2)CC3=CC=CC=C3)I

InChI

InChI=1S/C18H17IN2O2/c1-13(22)23-11-9-15-16-8-5-10-20-18(16)21(17(15)19)12-14-6-3-2-4-7-14/h2-8,10H,9,11-12H2,1H3