N-(3-chloranyl-2-methyl-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propionamide Formula: C16H26ClN3O2+2 MolecularWeight: 327.84954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+]2CC[NH+](CC2)CCO

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CC[NH+]2CC[NH+](CC2)CCO

InChI

InChI=1S/C16H24ClN3O2/c1-13-14(17)3-2-4-15(13)18-16(22)5-6-19-7-9-20(10-8-19)11-12-21/h2-4,21H,5-12H2,1H3,(H,18,22)/p+2