4-[[[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amino]methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amino]methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amino]methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[[4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]amino]methylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amino]methylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]amino]methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C25H26N3O2+ MolecularWeight: 400.49284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35)C=CC1=O

Isomeric SMILES

COC1=CC(=CNN2CC[NH+](CC2)C3C4=CC=CC=C4C5=CC=CC=C35)C=CC1=O

InChI

InChI=1S/C25H25N3O2/c1-30-24-16-18(10-11-23(24)29)17-26-28-14-12-27(13-15-28)25-21-8-4-2-6-19(21)20-7-3-5-9-22(20)25/h2-11,16-17,25-26H,12-15H2,1H3/p+1