(2E)-2-[(2E)-2-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one

Systemtic Name: (2E)-2-[(2E)-2-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one Openeye Name: (2E)-2-[(2E)-2-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one CAS Name: (2E)-2-[(2E)-2-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one IUPAC Name: (2E)-2-[(2E)-2-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one Traditional Name: (2E)-2-[(2E)-2-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)ethylidene]-6-methyl-1,5-diphenyl-5H-pyrimidin-1-ium-4-one Formula: C25H20BrN2O2+ MolecularWeight: 460.3425

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C2C=C(C=CC2=O)Br)NC(=O)C1C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=[N+](/C(=C/C=C/2\C=C(C=CC2=O)Br)/NC(=O)C1C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H19BrN2O2/c1-17-24(18-8-4-2-5-9-18)25(30)27-23(28(17)21-10-6-3-7-11-21)15-12-19-16-20(26)13-14-22(19)29/h2-16,24H,1H3/p+1