methyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[4-(4-nitrophenyl)-1-piperazinyl]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethoxy]benzoic acid methyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-28-20(25)15-2-8-18(9-3-15)29-14-19(24)22-12-10-21(11-13-22)16-4-6-17(7-5-16)23(26)27/h2-9H,10-14H2,1H3