(2R)-N-(2-chloranylpyridin-3-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(2-chloranylpyridin-3-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(2-chloro-3-pyridyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(2-chloro-3-pyridinyl)-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2-chloropyridin-3-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(2-chloro-3-pyridyl)-2-(4-o-phenetylpiperazin-1-ium-1-yl)propionamide Formula: C20H26ClN4O2+ MolecularWeight: 389.89904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)C(C)C(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H25ClN4O2/c1-3-27-18-9-5-4-8-17(18)25-13-11-24(12-14-25)15(2)20(26)23-16-7-6-10-22-19(16)21/h4-10,15H,3,11-14H2,1-2H3,(H,23,26)/p+1/t15-/m1/s1