methyl 2-(3-oxidanylidene-1-phenyl-1$l^{3},2-benziodazol-2-yl)propanoate

Systemtic Name: methyl 2-(3-oxidanylidene-1-phenyl-1$l^{3},2-benziodazol-2-yl)propanoate Openeye Name: methyl 2-(3-oxo-1-phenyl-1$l^{3},2-benziodazol-2-yl)propanoate CAS Name: 2-(3-oxo-1-phenyl-1$l^{3},2-benziodazol-2-yl)propanoic acid methyl ester IUPAC Name: methyl 2-(3-oxo-1-phenyl-1$l^{3},2-benziodazol-2-yl)propanoate Traditional Name: 2-(3-keto-1-phenyl-1$l^{3},2-benziodazol-2-yl)propionic acid methyl ester Formula: C17H16INO3 MolecularWeight: 409.21831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1C(=O)C2=CC=CC=C2I1C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC)N1C(=O)C2=CC=CC=C2I1C3=CC=CC=C3

InChI

InChI=1S/C17H16INO3/c1-12(17(21)22-2)19-16(20)14-10-6-7-11-15(14)18(19)13-8-4-3-5-9-13/h3-12H,1-2H3