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3-[(5-iodanylfuran-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid

3-[(5-iodanylfuran-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name:3-[(5-iodanylfuran-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid
Openeye Name:3-[(5-iodo-2-furyl)methylamino]-3-(2-thienyl)propanoic acid
CAS Name:3-[(5-iodo-2-furanyl)methylamino]-3-thiophen-2-ylpropanoic acid
IUPAC Name:3-[(5-iodofuran-2-yl)methylamino]-3-thiophen-2-ylpropanoic acid
Traditional Name:3-[(5-iodo-2-furyl)methylamino]-3-(2-thienyl)propionic acid
Formula: C12H12INO3S
MolecularWeight: 377.19805
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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NCC2=CC=C(O2)I


Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NCC2=CC=C(O2)I


InChI

InChI=1S/C12H12INO3S/c13-11-4-3-8(17-11)7-14-9(6-12(15)16)10-2-1-5-18-10/h1-5,9,14H,6-7H2,(H,15,16)


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