tert-butyl N-[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamate

Systemtic Name: tert-butyl N-[(3-methoxy-5-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamate Openeye Name: tert-butyl N-[(3-methoxy-5-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamate CAS Name: N-[(3-methoxy-5-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-methoxy-5-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]carbamate Traditional Name: N-[(4-keto-3-methoxy-5-nitro-cyclohexa-2,5-dien-1-ylidene)methylamino]carbamic acid tert-butyl ester Formula: C13H17N3O6 MolecularWeight: 311.29058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC=C1C=C(C(=O)C(=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NNC=C1C=C(C(=O)C(=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O6/c1-13(2,3)22-12(18)15-14-7-8-5-9(16(19)20)11(17)10(6-8)21-4/h5-7,14H,1-4H3,(H,15,18)