2-methylpropyl 2-(3-imidazol-1-ylpropylamino)benzoate

Systemtic Name: 2-methylpropyl 2-(3-imidazol-1-ylpropylamino)benzoate Openeye Name: isobutyl 2-(3-imidazol-1-ylpropylamino)benzoate CAS Name: 2-[3-(1-imidazolyl)propylamino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(3-imidazol-1-ylpropylamino)benzoate Traditional Name: 2-(3-imidazol-1-ylpropylamino)benzoic acid isobutyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=CC=C1NCCCN2C=CN=C2

Isomeric SMILES

CC(C)COC(=O)C1=CC=CC=C1NCCCN2C=CN=C2

InChI

InChI=1S/C17H23N3O2/c1-14(2)12-22-17(21)15-6-3-4-7-16(15)19-8-5-10-20-11-9-18-13-20/h3-4,6-7,9,11,13-14,19H,5,8,10,12H2,1-2H3