3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 4-(tert-butoxycarbonylamino)benzoate CAS Name: 4-[[(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 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 4-(tert-butoxycarbonylamino)benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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