N-(2-ethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-ethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(2-ethylphenyl)-4-(3-pyridylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2-ethylphenyl)-4-(3-pyridinylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-ethylphenyl)-4-(pyridin-3-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(2-ethylphenyl)-4-(3-pyridylmethyl)piperazin-4-ium-1-carboxamide Formula: C19H25N4O+ MolecularWeight: 325.428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CC3=CN=CC=C3

InChI

InChI=1S/C19H24N4O/c1-2-17-7-3-4-8-18(17)21-19(24)23-12-10-22(11-13-23)15-16-6-5-9-20-14-16/h3-9,14H,2,10-13,15H2,1H3,(H,21,24)/p+1