tert-butyl N-[5-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-2-methoxy-phenyl]carbamate

Systemtic Name: tert-butyl N-[5-[(4-ethoxy-3-nitro-phenyl)carbonylamino]-2-methoxy-phenyl]carbamate Openeye Name: tert-butyl N-[5-[(4-ethoxy-3-nitro-benzoyl)amino]-2-methoxy-phenyl]carbamate CAS Name: N-[5-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[(4-ethoxy-3-nitrobenzoyl)amino]-2-methoxyphenyl]carbamate Traditional Name: N-[5-[(4-ethoxy-3-nitro-benzoyl)amino]-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)NC(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O7/c1-6-30-18-9-7-13(11-16(18)24(27)28)19(25)22-14-8-10-17(29-5)15(12-14)23-20(26)31-21(2,3)4/h7-12H,6H2,1-5H3,(H,22,25)(H,23,26)