2-[(4-propylpiperazin-4-ium-1-yl)methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 2-[(4-propyl-1-piperazin-4-iumyl)methyl]-4-(1H-pyrazin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]-4-(1H-pyrazin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CC2=CC(=C3C=NC=CN3)C=CC2=O

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC2=CC(=C3C=NC=CN3)C=CC2=O

InChI

InChI=1S/C18H24N4O/c1-2-7-21-8-10-22(11-9-21)14-16-12-15(3-4-18(16)23)17-13-19-5-6-20-17/h3-6,12-13,20H,2,7-11,14H2,1H3/p+1