tert-butyl 3-(1,3-benzoxazol-2-ylmethyl)-2-oxidanylidene-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 3-(1,3-benzoxazol-2-ylmethyl)-2-oxidanylidene-benzimidazole-1-carboxylate Openeye Name: tert-butyl 3-(1,3-benzoxazol-2-ylmethyl)-2-oxo-benzimidazole-1-carboxylate CAS Name: 3-(1,3-benzoxazol-2-ylmethyl)-2-oxo-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(1,3-benzoxazol-2-ylmethyl)-2-oxobenzimidazole-1-carboxylate Traditional Name: 3-(1,3-benzoxazol-2-ylmethyl)-2-keto-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2N(C1=O)CC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2N(C1=O)CC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H19N3O4/c1-20(2,3)27-19(25)23-15-10-6-5-9-14(15)22(18(23)24)12-17-21-13-8-4-7-11-16(13)26-17/h4-11H,12H2,1-3H3