[4-(1H-benzimidazol-2-ylamino)-2,2-dimethyl-4-oxidanylidene-3-phenylmethoxy-butyl] ethanoate

Systemtic Name: [4-(1H-benzimidazol-2-ylamino)-2,2-dimethyl-4-oxidanylidene-3-phenylmethoxy-butyl] ethanoate Openeye Name: [4-(1H-benzimidazol-2-ylamino)-3-benzyloxy-2,2-dimethyl-4-oxo-butyl] acetate CAS Name: acetic acid [4-(1H-benzimidazol-2-ylamino)-2,2-dimethyl-4-oxo-3-phenylmethoxybutyl] ester IUPAC Name: [4-(1H-benzimidazol-2-ylamino)-2,2-dimethyl-4-oxo-3-phenylmethoxybutyl] acetate Traditional Name: acetic acid [4-(1H-benzimidazol-2-ylamino)-3-benzoxy-4-keto-2,2-dimethyl-butyl] ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)C(C(=O)NC1=NC2=CC=CC=C2N1)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)OCC(C)(C)C(C(=O)NC1=NC2=CC=CC=C2N1)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O4/c1-15(26)29-14-22(2,3)19(28-13-16-9-5-4-6-10-16)20(27)25-21-23-17-11-7-8-12-18(17)24-21/h4-12,19H,13-14H2,1-3H3,(H2,23,24,25,27)