methyl 2-[[4-[(E)-3-(oxidanylamino)-3-oxidanylidene-prop-1-enyl]phenyl]methyl]-4-phenyl-1H-imidazole-5-carboxylate

Systemtic Name: methyl 2-[[4-[(E)-3-(oxidanylamino)-3-oxidanylidene-prop-1-enyl]phenyl]methyl]-4-phenyl-1H-imidazole-5-carboxylate Openeye Name: methyl 2-[[4-[(E)-3-(hydroxyamino)-3-oxo-prop-1-enyl]phenyl]methyl]-4-phenyl-1H-imidazole-5-carboxylate CAS Name: 2-[[4-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]phenyl]methyl]-4-phenyl-1H-imidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]phenyl]methyl]-4-phenyl-1H-imidazole-5-carboxylate Traditional Name: 2-[4-[(E)-3-(hydroxyamino)-3-keto-prop-1-enyl]benzyl]-4-phenyl-1H-imidazole-5-carboxylic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(N1)CC2=CC=C(C=C2)C=CC(=O)NO)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(N=C(N1)CC2=CC=C(C=C2)/C=C/C(=O)NO)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4/c1-28-21(26)20-19(16-5-3-2-4-6-16)22-17(23-20)13-15-9-7-14(8-10-15)11-12-18(25)24-27/h2-12,27H,13H2,1H3,(H,22,23)(H,24,25)/b12-11+