6-[4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-ethyl-1-piperazin-4-iumyl)-6-methyl-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-6-methyl-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=C3C=CC=CC3=O)NC(=C2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=C3C=CC=CC3=O)NC(=C2)C

InChI

InChI=1S/C17H22N4O/c1-3-20-8-10-21(11-9-20)16-12-13(2)18-17(19-16)14-6-4-5-7-15(14)22/h4-7,12,18H,3,8-11H2,1-2H3/p+1