3-(diphenylmethylidene)-1-[4-(4-phenylpiperazin-1-ium-1-yl)butyl]pyrrolidine-2,5-dione

Systemtic Name: 3-(diphenylmethylidene)-1-[4-(4-phenylpiperazin-1-ium-1-yl)butyl]pyrrolidine-2,5-dione Openeye Name: 3-benzhydrylidene-1-[4-(4-phenylpiperazin-1-ium-1-yl)butyl]pyrrolidine-2,5-dione CAS Name: 3-(diphenylmethylene)-1-[4-(4-phenyl-1-piperazin-1-iumyl)butyl]pyrrolidine-2,5-dione IUPAC Name: 3-benzhydrylidene-1-[4-(4-phenylpiperazin-1-ium-1-yl)butyl]pyrrolidine-2,5-dione Traditional Name: 3-benzhydrylidene-1-[4-(4-phenylpiperazin-1-ium-1-yl)butyl]pyrrolidine-2,5-quinone Formula: C31H34N3O2+ MolecularWeight: 480.62056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCCN2C(=O)CC(=C(C3=CC=CC=C3)C4=CC=CC=C4)C2=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CCCCN2C(=O)CC(=C(C3=CC=CC=C3)C4=CC=CC=C4)C2=O)C5=CC=CC=C5

InChI

InChI=1S/C31H33N3O2/c35-29-24-28(30(25-12-4-1-5-13-25)26-14-6-2-7-15-26)31(36)34(29)19-11-10-18-32-20-22-33(23-21-32)27-16-8-3-9-17-27/h1-9,12-17H,10-11,18-24H2/p+1