2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazin-1-yl]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[4-(2-methyl-1-oxo-2-phenylpropyl)-1-piperazinyl]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[4-(2-methyl-2-phenylpropanoyl)piperazin-1-yl]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[4-(2-methyl-2-phenyl-propanoyl)piperazino]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C23H24N4O5 MolecularWeight: 436.46046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O5/c1-23(2,16-7-4-3-5-8-16)22(30)25-13-11-24(12-14-25)15-26-20(28)17-9-6-10-18(27(31)32)19(17)21(26)29/h3-10H,11-15H2,1-2H3