1-(2,3-dimethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(2,3-dimethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium Openeye Name: 1-(2,3-dimethylphenyl)-4-(3-pyridylmethyl)piperazin-4-ium CAS Name: 1-(2,3-dimethylphenyl)-4-(3-pyridinylmethyl)piperazin-4-ium IUPAC Name: 1-(2,3-dimethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium Traditional Name: 1-(2,3-dimethylphenyl)-4-(3-pyridylmethyl)piperazin-4-ium Formula: C18H24N3+ MolecularWeight: 282.40326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CN=CC=C3)C

InChI

InChI=1S/C18H23N3/c1-15-5-3-7-18(16(15)2)21-11-9-20(10-12-21)14-17-6-4-8-19-13-17/h3-8,13H,9-12,14H2,1-2H3/p+1