ethyl 4-[1-(3-imidazol-1-ylpropylamino)ethyl]benzoate

Systemtic Name: ethyl 4-[1-(3-imidazol-1-ylpropylamino)ethyl]benzoate Openeye Name: ethyl 4-[1-(3-imidazol-1-ylpropylamino)ethyl]benzoate CAS Name: 4-[1-[3-(1-imidazolyl)propylamino]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-(3-imidazol-1-ylpropylamino)ethyl]benzoate Traditional Name: 4-[1-(3-imidazol-1-ylpropylamino)ethyl]benzoic acid ethyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(C)NCCCN2C=CN=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(C)NCCCN2C=CN=C2

InChI

InChI=1S/C17H23N3O2/c1-3-22-17(21)16-7-5-15(6-8-16)14(2)19-9-4-11-20-12-10-18-13-20/h5-8,10,12-14,19H,3-4,9,11H2,1-2H3