3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-(tert-butoxycarbonylamino)benzoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 3-(tert-butoxycarbonylamino)benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)OCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)OCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C22H25N3O5/c1-22(2,3)30-21(28)23-16-9-6-8-15(14-16)19(26)29-13-7-12-25-18-11-5-4-10-17(18)24-20(25)27/h4-6,8-11,14H,7,12-13H2,1-3H3,(H,23,28)(H,24,27)