tert-butyl N-methyl-N-[5-(2-morpholin-4-ylphenoxy)-2-nitro-phenyl]carbamate

Systemtic Name: tert-butyl N-methyl-N-[5-(2-morpholin-4-ylphenoxy)-2-nitro-phenyl]carbamate Openeye Name: tert-butyl N-methyl-N-[5-(2-morpholinophenoxy)-2-nitro-phenyl]carbamate CAS Name: N-methyl-N-[5-[2-(4-morpholinyl)phenoxy]-2-nitrophenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methyl-N-[5-(2-morpholin-4-ylphenoxy)-2-nitrophenyl]carbamate Traditional Name: N-methyl-N-[5-(2-morpholinophenoxy)-2-nitro-phenyl]carbamic acid tert-butyl ester Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C1=C(C=CC(=C1)OC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C1=C(C=CC(=C1)OC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O6/c1-22(2,3)31-21(26)23(4)19-15-16(9-10-17(19)25(27)28)30-20-8-6-5-7-18(20)24-11-13-29-14-12-24/h5-10,15H,11-14H2,1-4H3