[1-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 2,2-dimethylpropanoate

Systemtic Name: [1-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 2,2-dimethylpropanoate Openeye Name: [1-benzyl-2-[[1-(1H-imidazol-5-ylmethyl)-2-methoxy-2-oxo-ethyl]amino]-2-oxo-ethyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [1-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [1-[[3-(1H-imidazol-5-yl)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-benzyl-2-[[1-(1H-imidazol-5-ylmethyl)-2-keto-2-methoxy-ethyl]amino]-2-keto-ethyl] ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)OC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)OC

InChI

InChI=1S/C21H27N3O5/c1-21(2,3)20(27)29-17(10-14-8-6-5-7-9-14)18(25)24-16(19(26)28-4)11-15-12-22-13-23-15/h5-9,12-13,16-17H,10-11H2,1-4H3,(H,22,23)(H,24,25)