ethyl 4-[[(5E)-5-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[(5E)-5-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[(5E)-5-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[(5E)-5-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(5E)-5-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[(5E)-5-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)-2H-1,2,4-oxadiazol-3-yl]methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NC(=C3C=C(C=CC3=O)C)ON2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=N/C(=C\3/C=C(C=CC3=O)C)/ON2

InChI

InChI=1S/C17H22N4O4/c1-3-24-17(23)21-8-6-20(7-9-21)11-15-18-16(25-19-15)13-10-12(2)4-5-14(13)22/h4-5,10H,3,6-9,11H2,1-2H3,(H,18,19)/b16-13+