4-bromanyl-6-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[(4-methyl-1-piperazin-4-iumyl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C12H17BrN3O+ MolecularWeight: 299.18688

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC=C2C=C(C=CC2=O)Br

Isomeric SMILES

C[NH+]1CCN(CC1)NC=C2C=C(C=CC2=O)Br

InChI

InChI=1S/C12H16BrN3O/c1-15-4-6-16(7-5-15)14-9-10-8-11(13)2-3-12(10)17/h2-3,8-9,14H,4-7H2,1H3/p+1