1-[4-[4-(2-methylprop-2-enyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-[4-(2-methylprop-2-enyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-[4-(2-methylallyl)piperazin-1-yl]-3-nitro-phenyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[4-(2-methylprop-2-enyl)-1-piperazinyl]-3-nitrophenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-[4-(2-methylprop-2-enyl)piperazin-1-yl]-3-nitrophenyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[4-(2-methylallyl)piperazino]-3-nitro-phenyl]pyrrolidine-2,5-quinone Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1CCN(CC1)C2=C(C=C(C=C2)N3C(=O)CCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC(=C)CN1CCN(CC1)C2=C(C=C(C=C2)N3C(=O)CCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4/c1-13(2)12-19-7-9-20(10-8-19)15-4-3-14(11-16(15)22(25)26)21-17(23)5-6-18(21)24/h3-4,11H,1,5-10,12H2,2H3