N,2,3-trimethyl-6-(1-phenylpiperazin-1-ium-1-yl)pyrimidin-3-ium-4-amine

Systemtic Name: N,2,3-trimethyl-6-(1-phenylpiperazin-1-ium-1-yl)pyrimidin-3-ium-4-amine Openeye Name: N,2,3-trimethyl-6-(1-phenylpiperazin-1-ium-1-yl)pyrimidin-3-ium-4-amine CAS Name: N,2,3-trimethyl-6-(1-phenyl-1-piperazin-1-iumyl)-4-pyrimidin-3-iumamine IUPAC Name: N,2,3-trimethyl-6-(1-phenylpiperazin-1-ium-1-yl)pyrimidin-3-ium-4-amine Traditional Name: [2,3-dimethyl-6-(1-phenylpiperazin-1-ium-1-yl)pyrimidin-3-ium-4-yl]-methyl-amine Formula: C17H25N5+2 MolecularWeight: 299.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=[N+]1C)NC)[N+]2(CCNCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=[N+]1C)NC)[N+]2(CCNCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H24N5/c1-14-20-17(13-16(18-2)21(14)3)22(11-9-19-10-12-22)15-7-5-4-6-8-15/h4-8,13,19H,9-12H2,1-3H3/q+1/p+1