2-(4-butan-2-ylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]ethanehydrazide

Systemtic Name: 2-(4-butan-2-ylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]ethanehydrazide Openeye Name: N'-[(E)-(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-sec-butylphenoxy)acetohydrazide CAS Name: 2-(4-butan-2-ylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]acetohydrazide IUPAC Name: 2-(4-butan-2-ylphenoxy)-N'-[(E)-(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]acetohydrazide Traditional Name: N'-[(E)-(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)methyl]-2-(4-sec-butylphenoxy)acetohydrazide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC=C2C=C(C(=O)C(=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NN/C=C/2\C=C(C(=O)C(=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O6/c1-4-13(2)15-5-7-16(8-6-15)29-12-19(24)22-21-11-14-9-17(23(26)27)20(25)18(10-14)28-3/h5-11,13,21H,4,12H2,1-3H3,(H,22,24)/b14-11+