tert-butyl (NE)-N-[[5-azanyl-2-(2-ethoxy-6-nitro-phenyl)phenyl]methylidene]carbamate

Systemtic Name: tert-butyl (NE)-N-[[5-azanyl-2-(2-ethoxy-6-nitro-phenyl)phenyl]methylidene]carbamate Openeye Name: tert-butyl (NE)-N-[[5-amino-2-(2-ethoxy-6-nitro-phenyl)phenyl]methylene]carbamate CAS Name: (NE)-N-[[5-amino-2-(2-ethoxy-6-nitrophenyl)phenyl]methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NE)-N-[[5-amino-2-(2-ethoxy-6-nitrophenyl)phenyl]methylidene]carbamate Traditional Name: (NE)-N-[5-amino-2-(2-ethoxy-6-nitro-phenyl)benzylidene]carbamic acid tert-butyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1C2=C(C=C(C=C2)N)C=NC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1C2=C(C=C(C=C2)N)/C=N/C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5/c1-5-27-17-8-6-7-16(23(25)26)18(17)15-10-9-14(21)11-13(15)12-22-19(24)28-20(2,3)4/h6-12H,5,21H2,1-4H3/b22-12+