methyl N-[5-[3,5-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]phenoxy]-2-nitro-phenyl]carbamate

Systemtic Name: methyl N-[5-[3,5-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]phenoxy]-2-nitro-phenyl]carbamate Openeye Name: methyl N-[5-[4-(tert-butoxycarbonylamino)-3,5-dimethyl-phenoxy]-2-nitro-phenyl]carbamate CAS Name: N-[5-[3,5-dimethyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenoxy]-2-nitrophenyl]carbamic acid methyl ester IUPAC Name: methyl N-[5-[3,5-dimethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]phenoxy]-2-nitrophenyl]carbamate Traditional Name: N-[5-[4-(tert-butoxycarbonylamino)-3,5-dimethyl-phenoxy]-2-nitro-phenyl]carbamic acid methyl ester Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)OC(C)(C)C)C)OC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)OC(C)(C)C)C)OC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)OC

InChI

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