tert-butyl N-[[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]carbonylamino]carbamate

Systemtic Name: tert-butyl N-[[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]carbonylamino]carbamate Openeye Name: tert-butyl N-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]carbamate CAS Name: N-[[[4-(4-chloro-2-nitrophenoxy)-3-methoxyphenyl]-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoyl]amino]carbamate Traditional Name: N-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]carbamic acid tert-butyl ester Formula: C19H20ClN3O7 MolecularWeight: 437.831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20ClN3O7/c1-19(2,3)30-18(25)22-21-17(24)11-5-7-15(16(9-11)28-4)29-14-8-6-12(20)10-13(14)23(26)27/h5-10H,1-4H3,(H,21,24)(H,22,25)