2-[3-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-3-keto-propyl]isoindoline-1,3-quinone Formula: C28H26N3O3+ MolecularWeight: 452.52434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C28H25N3O3/c32-25(13-14-31-27(33)23-11-5-6-12-24(23)28(31)34)29-15-17-30(18-16-29)26-21-9-3-1-7-19(21)20-8-2-4-10-22(20)26/h1-12,26H,13-18H2/p+1