tert-butyl N-[[(E)-(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamate

Systemtic Name: tert-butyl N-[[(E)-(5-ethoxy-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamate Openeye Name: tert-butyl N-[[(E)-(5-ethoxy-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamate CAS Name: N-[[(E)-(5-ethoxy-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[(E)-(5-ethoxy-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamate Traditional Name: N-[[(E)-(5-ethoxy-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]carbamic acid tert-butyl ester Formula: C14H19N3O6 MolecularWeight: 325.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=CNNC(=O)OC(C)(C)C)C1=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C/C(=C\NNC(=O)OC(C)(C)C)/C1=O)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O6/c1-5-22-11-7-10(17(20)21)6-9(12(11)18)8-15-16-13(19)23-14(2,3)4/h6-8,15H,5H2,1-4H3,(H,16,19)/b9-8+