3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide Openeye Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propanamide CAS Name: 3-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-N-(2-methoxy-5-methylphenyl)propanamide IUPAC Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-(2-methoxy-5-methylphenyl)propanamide Traditional Name: 3-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-N-(2-methoxy-5-methyl-phenyl)propionamide Formula: C17H28N3O3+ MolecularWeight: 322.42252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CC[NH+]2CCN(CC2)CCO

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CC[NH+]2CCN(CC2)CCO

InChI

InChI=1S/C17H27N3O3/c1-14-3-4-16(23-2)15(13-14)18-17(22)5-6-19-7-9-20(10-8-19)11-12-21/h3-4,13,21H,5-12H2,1-2H3,(H,18,22)/p+1