6-[[[4-(diphenylmethyl)piperazin-4-ium-1-yl]amino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(diphenylmethyl)piperazin-4-ium-1-yl]amino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(4-benzhydrylpiperazin-4-ium-1-yl)amino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[4-(diphenylmethyl)-1-piperazin-4-iumyl]amino]methylidene]-2-ethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(4-benzhydrylpiperazin-4-ium-1-yl)amino]methylidene]-2-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[(4-benzhydrylpiperazin-4-ium-1-yl)amino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNN2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNN2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C1=O

InChI

InChI=1S/C26H29N3O2/c1-2-31-24-15-9-14-23(26(24)30)20-27-29-18-16-28(17-19-29)25(21-10-5-3-6-11-21)22-12-7-4-8-13-22/h3-15,20,25,27H,2,16-19H2,1H3/p+1