2-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]pyrimidine

Systemtic Name: 2-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]pyrimidine Openeye Name: 2-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]pyrimidine CAS Name: 2-[4-(3-phenylpropyl)-1-piperazin-4-iumyl]pyrimidine IUPAC Name: 2-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]pyrimidine Traditional Name: 2-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]pyrimidine Formula: C17H23N4+ MolecularWeight: 283.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CC=C2)C3=NC=CC=N3

InChI

InChI=1S/C17H22N4/c1-2-6-16(7-3-1)8-4-11-20-12-14-21(15-13-20)17-18-9-5-10-19-17/h1-3,5-7,9-10H,4,8,11-15H2/p+1