methyl 3-[[4-methoxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[4-methoxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[3-(tert-butoxycarbonylamino)-4-methoxy-phenyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[4-methoxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]anilino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[4-methoxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[[3-(tert-butoxycarbonylamino)-4-methoxy-phenyl]carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C21H23N3O8 MolecularWeight: 445.42262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C21H23N3O8/c1-21(2,3)32-20(27)23-16-11-14(6-7-17(16)30-4)22-18(25)12-8-13(19(26)31-5)10-15(9-12)24(28)29/h6-11H,1-5H3,(H,22,25)(H,23,27)