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5-iodanyl-1-[(5-nitrothiophen-2-yl)methoxy]isoquinoline

5-iodanyl-1-[(5-nitrothiophen-2-yl)methoxy]isoquinoline

Systemtic Name:5-iodanyl-1-[(5-nitrothiophen-2-yl)methoxy]isoquinoline
Openeye Name:5-iodo-1-[(5-nitro-2-thienyl)methoxy]isoquinoline
CAS Name:5-iodo-1-[(5-nitro-2-thiophenyl)methoxy]isoquinoline
IUPAC Name:5-iodo-1-[(5-nitrothiophen-2-yl)methoxy]isoquinoline
Traditional Name:5-iodo-1-[(5-nitro-2-thienyl)methoxy]isoquinoline
Formula: C14H9IN2O3S
MolecularWeight: 412.20233
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2OCC3=CC=C(S3)[N+](=O)[O-])C(=C1)I


Isomeric SMILES

C1=CC2=C(C=CN=C2OCC3=CC=C(S3)[N+](=O)[O-])C(=C1)I


InChI

InChI=1S/C14H9IN2O3S/c15-12-3-1-2-11-10(12)6-7-16-14(11)20-8-9-4-5-13(21-9)17(18)19/h1-7H,8H2


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