5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-2-(oxolan-2-ylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Openeye Name: 5-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 5-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]-2-(2-oxolanylmethyl)isoindole-1,3-dione IUPAC Name: 5-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 5-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C24H23ClN4O6 MolecularWeight: 498.91562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H23ClN4O6/c25-16-4-6-20(21(13-16)29(33)34)26-7-9-27(10-8-26)22(30)15-3-5-18-19(12-15)24(32)28(23(18)31)14-17-2-1-11-35-17/h3-6,12-13,17H,1-2,7-11,14H2