3-(1H-imidazol-5-yl)propyl 4-(4-iodophenyl)butanoate

Systemtic Name: 3-(1H-imidazol-5-yl)propyl 4-(4-iodophenyl)butanoate Openeye Name: 3-(1H-imidazol-5-yl)propyl 4-(4-iodophenyl)butanoate CAS Name: 4-(4-iodophenyl)butanoic acid 3-(1H-imidazol-5-yl)propyl ester IUPAC Name: 3-(1H-imidazol-5-yl)propyl 4-(4-iodophenyl)butanoate Traditional Name: 4-(4-iodophenyl)butyric acid 3-(1H-imidazol-5-yl)propyl ester Formula: C16H19IN2O2 MolecularWeight: 398.23873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(=O)OCCCC2=CN=CN2)I

Isomeric SMILES

C1=CC(=CC=C1CCCC(=O)OCCCC2=CN=CN2)I

InChI

InChI=1S/C16H19IN2O2/c17-14-8-6-13(7-9-14)3-1-5-16(20)21-10-2-4-15-11-18-12-19-15/h6-9,11-12H,1-5,10H2,(H,18,19)