3-[2-[imidazol-1-yl(propanoyl)amino]propan-2-yl]benzoate

Systemtic Name: 3-[2-[imidazol-1-yl(propanoyl)amino]propan-2-yl]benzoate Openeye Name: 3-[1-[imidazol-1-yl(propanoyl)amino]-1-methyl-ethyl]benzoate CAS Name: 3-[2-[1-imidazolyl(1-oxopropyl)amino]propan-2-yl]benzoate IUPAC Name: 3-[2-[imidazol-1-yl(propanoyl)amino]propan-2-yl]benzoate Traditional Name: 3-[1-[imidazol-1-yl(propionyl)amino]-1-methyl-ethyl]benzoate Formula: C16H18N3O3- MolecularWeight: 300.33242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C(C)(C)C1=CC=CC(=C1)C(=O)[O-])N2C=CN=C2

Isomeric SMILES

CCC(=O)N(C(C)(C)C1=CC=CC(=C1)C(=O)[O-])N2C=CN=C2

InChI

InChI=1S/C16H19N3O3/c1-4-14(20)19(18-9-8-17-11-18)16(2,3)13-7-5-6-12(10-13)15(21)22/h5-11H,4H2,1-3H3,(H,21,22)/p-1