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

Systemtic Name: (2R)-N-(2-chloranylpyridin-3-yl)-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloro-3-pyridyl)propanamide CAS Name: (2R)-N-(2-chloro-3-pyridinyl)-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloropyridin-3-yl)propanamide Traditional Name: (2R)-2-(4-benzylpiperazin-1-ium-1-yl)-N-(2-chloro-3-pyridyl)propionamide Formula: C19H24ClN4O+ MolecularWeight: 359.87306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(N=CC=C1)Cl)[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=C(N=CC=C1)Cl)[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H23ClN4O/c1-15(19(25)22-17-8-5-9-21-18(17)20)24-12-10-23(11-13-24)14-16-6-3-2-4-7-16/h2-9,15H,10-14H2,1H3,(H,22,25)/p+1/t15-/m1/s1