3-(1H-imidazol-5-yl)propyl 3-(3-iodanyl-4-methoxy-phenyl)propanoate

Systemtic Name: 3-(1H-imidazol-5-yl)propyl 3-(3-iodanyl-4-methoxy-phenyl)propanoate Openeye Name: 3-(1H-imidazol-5-yl)propyl 3-(3-iodo-4-methoxy-phenyl)propanoate CAS Name: 3-(3-iodo-4-methoxyphenyl)propanoic acid 3-(1H-imidazol-5-yl)propyl ester IUPAC Name: 3-(1H-imidazol-5-yl)propyl 3-(3-iodo-4-methoxyphenyl)propanoate Traditional Name: 3-(3-iodo-4-methoxy-phenyl)propionic acid 3-(1H-imidazol-5-yl)propyl ester Formula: C16H19IN2O3 MolecularWeight: 414.23813

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OCCCC2=CN=CN2)I

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OCCCC2=CN=CN2)I

InChI

InChI=1S/C16H19IN2O3/c1-21-15-6-4-12(9-14(15)17)5-7-16(20)22-8-2-3-13-10-18-11-19-13/h4,6,9-11H,2-3,5,7-8H2,1H3,(H,18,19)