N-(4-ethoxyphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(4-ethoxyphenyl)-4-(3-pyridylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-ethoxyphenyl)-4-(3-pyridinylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-ethoxyphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-p-phenetyl-4-(3-pyridylmethyl)piperazin-4-ium-1-carboxamide Formula: C19H25N4O2+ MolecularWeight: 341.4274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C19H24N4O2/c1-2-25-18-7-5-17(6-8-18)21-19(24)23-12-10-22(11-13-23)15-16-4-3-9-20-14-16/h3-9,14H,2,10-13,15H2,1H3,(H,21,24)/p+1