tert-butyl N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]carbamate

Systemtic Name: tert-butyl N-[(E)-(4-chloranyl-3-nitro-phenyl)methylideneamino]carbamate Openeye Name: tert-butyl N-[(E)-(4-chloro-3-nitro-phenyl)methyleneamino]carbamate CAS Name: N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(E)-(4-chloro-3-nitrophenyl)methylideneamino]carbamate Traditional Name: N-[(E)-(4-chloro-3-nitro-benzylidene)amino]carbamic acid tert-butyl ester Formula: C12H14ClN3O4 MolecularWeight: 299.71026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NN=CC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N/N=C/C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H14ClN3O4/c1-12(2,3)20-11(17)15-14-7-8-4-5-9(13)10(6-8)16(18)19/h4-7H,1-3H3,(H,15,17)/b14-7+