4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 4-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 4-[4-(2,5-dimethylphenyl)piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [4-[4-(2,5-dimethylphenyl)piperazino]pyridin-1-ium-3-yl]amine Formula: C17H23N4+ MolecularWeight: 283.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=C(C=[NH+]C=C3)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=C(C=[NH+]C=C3)N

InChI

InChI=1S/C17H22N4/c1-13-3-4-14(2)17(11-13)21-9-7-20(8-10-21)16-5-6-19-12-15(16)18/h3-6,11-12H,7-10,18H2,1-2H3/p+1