pentan-3-yl 2-(4,5-dihydro-1H-imidazol-2-ylmethylamino)benzoate

Systemtic Name: pentan-3-yl 2-(4,5-dihydro-1H-imidazol-2-ylmethylamino)benzoate Openeye Name: 1-ethylpropyl 2-(4,5-dihydro-1H-imidazol-2-ylmethylamino)benzoate CAS Name: 2-(4,5-dihydro-1H-imidazol-2-ylmethylamino)benzoic acid pentan-3-yl ester IUPAC Name: pentan-3-yl 2-(4,5-dihydro-1H-imidazol-2-ylmethylamino)benzoate Traditional Name: 2-(2-imidazolin-2-ylmethylamino)benzoic acid 1-ethylpropyl ester Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC(=O)C1=CC=CC=C1NCC2=NCCN2

Isomeric SMILES

CCC(CC)OC(=O)C1=CC=CC=C1NCC2=NCCN2

InChI

InChI=1S/C16H23N3O2/c1-3-12(4-2)21-16(20)13-7-5-6-8-14(13)19-11-15-17-9-10-18-15/h5-8,12,19H,3-4,9-11H2,1-2H3,(H,17,18)