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

Systemtic Name: 4-bromanyl-6-[[[4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[[[4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[[[4-[(2,4-dimethylphenyl)methyl]-1-piperazin-4-iumyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[[[4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[[[4-(2,4-dimethylbenzyl)piperazin-4-ium-1-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H25BrN3O+ MolecularWeight: 403.336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)NC=C3C=C(C=CC3=O)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)NC=C3C=C(C=CC3=O)Br)C

InChI

InChI=1S/C20H24BrN3O/c1-15-3-4-17(16(2)11-15)14-23-7-9-24(10-8-23)22-13-18-12-19(21)5-6-20(18)25/h3-6,11-13,22H,7-10,14H2,1-2H3/p+1