3-(1H-imidazol-5-yl)propyl 4-phenylbutanoate

Systemtic Name: 3-(1H-imidazol-5-yl)propyl 4-phenylbutanoate Openeye Name: 3-(1H-imidazol-5-yl)propyl 4-phenylbutanoate CAS Name: 4-phenylbutanoic acid 3-(1H-imidazol-5-yl)propyl ester IUPAC Name: 3-(1H-imidazol-5-yl)propyl 4-phenylbutanoate Traditional Name: 4-phenylbutyric acid 3-(1H-imidazol-5-yl)propyl ester Formula: C16H20N2O2 MolecularWeight: 272.3422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)OCCCC2=CN=CN2

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)OCCCC2=CN=CN2

InChI

InChI=1S/C16H20N2O2/c19-16(10-4-8-14-6-2-1-3-7-14)20-11-5-9-15-12-17-13-18-15/h1-3,6-7,12-13H,4-5,8-11H2,(H,17,18)