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

Systemtic Name: ethyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-[4-(4-nitrophenyl)piperazino]ethoxy]benzoic acid ethyl ester Formula: C21H23N3O6 MolecularWeight: 413.42382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O6/c1-2-29-21(26)16-3-9-19(10-4-16)30-15-20(25)23-13-11-22(12-14-23)17-5-7-18(8-6-17)24(27)28/h3-10H,2,11-15H2,1H3