5-methyl-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 5-methyl-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 5-methyl-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 5-methyl-2-[2-[4-(2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 5-methyl-2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-[4-(2-nitrophenyl)piperazino]ethyl]-5-methyl-isoindoline-1,3-quinone Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5/c1-14-6-7-15-16(12-14)21(28)24(20(15)27)13-19(26)23-10-8-22(9-11-23)17-4-2-3-5-18(17)25(29)30/h2-7,12H,8-11,13H2,1H3