3-fluoren-9-ylidene-1-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolidine-2,5-dione hydrate hydrochloride

Systemtic Name: 3-fluoren-9-ylidene-1-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolidine-2,5-dione hydrate hydrochloride Openeye Name: 3-fluoren-9-ylidene-1-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolidine-2,5-dione hydrate hydrochloride CAS Name: 3-(9-fluorenylidene)-1-[4-(4-phenyl-1-piperazinyl)butyl]pyrrolidine-2,5-dione hydrate hydrochloride IUPAC Name: 3-fluoren-9-ylidene-1-[4-(4-phenylpiperazin-1-yl)butyl]pyrrolidine-2,5-dione hydrate hydrochloride Traditional Name: 3-fluoren-9-ylidene-1-[4-(4-phenylpiperazino)butyl]pyrrolidine-2,5-quinone hydrate hydrochloride Formula: C31H34ClN3O3 MolecularWeight: 532.07296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)CC(=C3C4=CC=CC=C4C5=CC=CC=C53)C2=O)C6=CC=CC=C6.O.Cl

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)CC(=C3C4=CC=CC=C4C5=CC=CC=C53)C2=O)C6=CC=CC=C6.O.Cl

InChI

InChI=1S/C31H31N3O2.ClH.H2O/c35-29-22-28(30-26-14-6-4-12-24(26)25-13-5-7-15-27(25)30)31(36)34(29)17-9-8-16-32-18-20-33(21-19-32)23-10-2-1-3-11-23;;/h1-7,10-15H,8-9,16-22H2;1H;1H2