(phenylmethyl) 1-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]imidazole-4-carboxylate

Systemtic Name: (phenylmethyl) 1-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]imidazole-4-carboxylate Openeye Name: benzyl 1-[(1S)-1-methoxycarbonyl-2-methyl-propyl]imidazole-4-carboxylate CAS Name: 1-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]-4-imidazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]imidazole-4-carboxylate Traditional Name: 1-[(1S)-1-carbomethoxy-2-methyl-propyl]imidazole-4-carboxylic acid benzyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)N1C=C(N=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)N1C=C(N=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O4/c1-12(2)15(17(21)22-3)19-9-14(18-11-19)16(20)23-10-13-7-5-4-6-8-13/h4-9,11-12,15H,10H2,1-3H3/t15-/m0/s1