6-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-allyl-6-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]amino]methylidene]-2-prop-2-enyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one Traditional Name: 2-allyl-6-[[[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4)C1=O

Isomeric SMILES

C=CCC1=CC=CC(=CNC2=NC3=CC=CC=C3N2CC[NH+]4CCCCC4)C1=O

InChI

InChI=1S/C24H28N4O/c1-2-9-19-10-8-11-20(23(19)29)18-25-24-26-21-12-4-5-13-22(21)28(24)17-16-27-14-6-3-7-15-27/h2,4-5,8,10-13,18H,1,3,6-7,9,14-17H2,(H,25,26)/p+1