3-chloranyl-1-(3-nitrophenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-1-(3-nitrophenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrrole-2,5-dione Openeye Name: 3-chloro-4-[4-[(E)-cinnamyl]piperazin-1-yl]-1-(3-nitrophenyl)pyrrole-2,5-dione CAS Name: 3-chloro-1-(3-nitrophenyl)-4-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]pyrrole-2,5-dione IUPAC Name: 3-chloro-1-(3-nitrophenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrrole-2,5-dione Traditional Name: 3-chloro-4-[4-[(E)-cinnamyl]piperazino]-1-(3-nitrophenyl)-3-pyrroline-2,5-quinone Formula: C23H21ClN4O4 MolecularWeight: 452.89024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H21ClN4O4/c24-20-21(23(30)27(22(20)29)18-9-4-10-19(16-18)28(31)32)26-14-12-25(13-15-26)11-5-8-17-6-2-1-3-7-17/h1-10,16H,11-15H2/b8-5+