tert-butyl N-[(4-azanyl-3-nitro-phenyl)methyl]carbamate

Systemtic Name: tert-butyl N-[(4-azanyl-3-nitro-phenyl)methyl]carbamate Openeye Name: tert-butyl N-[(4-amino-3-nitro-phenyl)methyl]carbamate CAS Name: N-[(4-amino-3-nitrophenyl)methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4-amino-3-nitrophenyl)methyl]carbamate Traditional Name: N-(4-amino-3-nitro-benzyl)carbamic acid tert-butyl ester Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC(=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4/c1-12(2,3)19-11(16)14-7-8-4-5-9(13)10(6-8)15(17)18/h4-6H,7,13H2,1-3H3,(H,14,16)