methyl 3-nitro-4-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethoxy]benzoate Openeye Name: methyl 4-[2-(4-isopropoxycarbonylanilino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 3-nitro-4-[2-oxo-2-[4-[oxo(propan-2-yloxy)methyl]anilino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[2-oxo-2-(4-propan-2-yloxycarbonylanilino)ethoxy]benzoate Traditional Name: 4-[2-(4-isopropoxycarbonylanilino)-2-keto-ethoxy]-3-nitro-benzoic acid methyl ester Formula: C20H20N2O8 MolecularWeight: 416.3814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O8/c1-12(2)30-20(25)13-4-7-15(8-5-13)21-18(23)11-29-17-9-6-14(19(24)28-3)10-16(17)22(26)27/h4-10,12H,11H2,1-3H3,(H,21,23)