methyl 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]acetate CAS Name: 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)piperazin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-(2,4-dinitrophenyl)piperazino]acetic acid methyl ester Formula: C19H19ClN4O6 MolecularWeight: 434.83036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O6/c1-30-19(25)18(14-4-2-3-5-15(14)20)22-10-8-21(9-11-22)16-7-6-13(23(26)27)12-17(16)24(28)29/h2-7,12,18H,8-11H2,1H3