3-fluoren-9-ylidene-1-[4-[4-(2-methylphenyl)piperazin-1-ium-1-yl]butyl]pyrrolidine-2,4-dione

Systemtic Name: 3-fluoren-9-ylidene-1-[4-[4-(2-methylphenyl)piperazin-1-ium-1-yl]butyl]pyrrolidine-2,4-dione Openeye Name: 3-fluoren-9-ylidene-1-[4-[4-(o-tolyl)piperazin-1-ium-1-yl]butyl]pyrrolidine-2,4-dione CAS Name: 3-(9-fluorenylidene)-1-[4-[4-(2-methylphenyl)-1-piperazin-1-iumyl]butyl]pyrrolidine-2,4-dione IUPAC Name: 3-fluoren-9-ylidene-1-[4-[4-(2-methylphenyl)piperazin-1-ium-1-yl]butyl]pyrrolidine-2,4-dione Traditional Name: 3-fluoren-9-ylidene-1-[4-[4-(o-tolyl)piperazin-1-ium-1-yl]butyl]pyrrolidine-2,4-quinone Formula: C32H34N3O2+ MolecularWeight: 492.63126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CCCCN3CC(=O)C(=C4C5=CC=CC=C5C6=CC=CC=C64)C3=O

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CCCCN3CC(=O)C(=C4C5=CC=CC=C5C6=CC=CC=C64)C3=O

InChI

InChI=1S/C32H33N3O2/c1-23-10-2-7-15-28(23)34-20-18-33(19-21-34)16-8-9-17-35-22-29(36)31(32(35)37)30-26-13-5-3-11-24(26)25-12-4-6-14-27(25)30/h2-7,10-15H,8-9,16-22H2,1H3/p+1