methyl 5-[(E)-1-iodanyl-4-(2-oxidanylidene-1,3-oxazolidin-3-yl)but-1-enyl]-2-methoxy-3-methyl-benzoate

Systemtic Name: methyl 5-[(E)-1-iodanyl-4-(2-oxidanylidene-1,3-oxazolidin-3-yl)but-1-enyl]-2-methoxy-3-methyl-benzoate Openeye Name: methyl 5-[(E)-1-iodo-4-(2-oxooxazolidin-3-yl)but-1-enyl]-2-methoxy-3-methyl-benzoate CAS Name: 5-[(E)-1-iodo-4-(2-oxo-3-oxazolidinyl)but-1-enyl]-2-methoxy-3-methylbenzoic acid methyl ester IUPAC Name: methyl 5-[(E)-1-iodo-4-(2-oxo-1,3-oxazolidin-3-yl)but-1-enyl]-2-methoxy-3-methylbenzoate Traditional Name: 5-[(E)-1-iodo-4-(2-ketooxazolidin-3-yl)but-1-enyl]-2-methoxy-3-methyl-benzoic acid methyl ester Formula: C17H20INO5 MolecularWeight: 445.24887

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C(=O)OC)C(=CCCN2CCOC2=O)I

Isomeric SMILES

CC1=CC(=CC(=C1OC)C(=O)OC)/C(=C\CCN2CCOC2=O)/I

InChI

InChI=1S/C17H20INO5/c1-11-9-12(10-13(15(11)22-2)16(20)23-3)14(18)5-4-6-19-7-8-24-17(19)21/h5,9-10H,4,6-8H2,1-3H3/b14-5+