tert-butyl N-[5-(4-azanyl-3,5-dimethyl-phenoxy)-2-nitro-phenyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[5-(4-azanyl-3,5-dimethyl-phenoxy)-2-nitro-phenyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[5-(4-amino-3,5-dimethyl-phenoxy)-2-nitro-phenyl]-N-methyl-carbamate CAS Name: N-[5-(4-amino-3,5-dimethylphenoxy)-2-nitrophenyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-(4-amino-3,5-dimethylphenoxy)-2-nitrophenyl]-N-methylcarbamate Traditional Name: N-[5-(4-amino-3,5-dimethyl-phenoxy)-2-nitro-phenyl]-N-methyl-carbamic acid tert-butyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N)C)OC2=CC(=C(C=C2)[N+](=O)[O-])N(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1N)C)OC2=CC(=C(C=C2)[N+](=O)[O-])N(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H25N3O5/c1-12-9-15(10-13(2)18(12)21)27-14-7-8-16(23(25)26)17(11-14)22(6)19(24)28-20(3,4)5/h7-11H,21H2,1-6H3