ethyl 5-[(Z)-4-methoxy-1-oxidanyl-3,4-bis(oxidanylidene)but-1-enyl]-1-(phenylmethyl)imidazole-4-carboxylate

Systemtic Name: ethyl 5-[(Z)-4-methoxy-1-oxidanyl-3,4-bis(oxidanylidene)but-1-enyl]-1-(phenylmethyl)imidazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-[(Z)-1-hydroxy-4-methoxy-3,4-dioxo-but-1-enyl]imidazole-4-carboxylate CAS Name: 5-[(Z)-1-hydroxy-4-methoxy-3,4-dioxobut-1-enyl]-1-(phenylmethyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[(Z)-1-hydroxy-4-methoxy-3,4-dioxobut-1-enyl]imidazole-4-carboxylate Traditional Name: 1-benzyl-5-[(Z)-1-hydroxy-3,4-diketo-4-methoxy-but-1-enyl]imidazole-4-carboxylic acid ethyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=N1)CC2=CC=CC=C2)C(=CC(=O)C(=O)OC)O

Isomeric SMILES

CCOC(=O)C1=C(N(C=N1)CC2=CC=CC=C2)/C(=C/C(=O)C(=O)OC)/O

InChI

InChI=1S/C18H18N2O6/c1-3-26-18(24)15-16(13(21)9-14(22)17(23)25-2)20(11-19-15)10-12-7-5-4-6-8-12/h4-9,11,21H,3,10H2,1-2H3/b13-9-