4-(2-phenoxyethyl)-N-pyridin-3-yl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-(2-phenoxyethyl)-N-pyridin-3-yl-piperazin-4-ium-1-carboxamide Openeye Name: 4-(2-phenoxyethyl)-N-(3-pyridyl)piperazin-4-ium-1-carboxamide CAS Name: 4-(2-phenoxyethyl)-N-(3-pyridinyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-(2-phenoxyethyl)-N-pyridin-3-ylpiperazin-4-ium-1-carboxamide Traditional Name: 4-(2-phenoxyethyl)-N-(3-pyridyl)piperazin-4-ium-1-carboxamide Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)NC3=CN=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)NC3=CN=CC=C3

InChI

InChI=1S/C18H22N4O2/c23-18(20-16-5-4-8-19-15-16)22-11-9-21(10-12-22)13-14-24-17-6-2-1-3-7-17/h1-8,15H,9-14H2,(H,20,23)/p+1