2-prop-2-enyl-6-[[[4-(pyridin-1-ium-4-ylmethyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 2-prop-2-enyl-6-[[[4-(pyridin-1-ium-4-ylmethyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-allyl-6-[[4-(pyridin-1-ium-4-ylmethyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-prop-2-enyl-6-[[4-(4-pyridin-1-iumylmethyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-prop-2-enyl-6-[[4-(pyridin-1-ium-4-ylmethyl)anilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-allyl-6-[[4-(pyridin-1-ium-4-ylmethyl)anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C22H21N2O+ MolecularWeight: 329.41494

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNC2=CC=C(C=C2)CC3=CC=[NH+]C=C3)C1=O

Isomeric SMILES

C=CCC1=CC=CC(=CNC2=CC=C(C=C2)CC3=CC=[NH+]C=C3)C1=O

InChI

InChI=1S/C22H20N2O/c1-2-4-19-5-3-6-20(22(19)25)16-24-21-9-7-17(8-10-21)15-18-11-13-23-14-12-18/h2-3,5-14,16,24H,1,4,15H2/p+1