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

Systemtic Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)propanamide Openeye Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)propanamide CAS Name: 3-[4-(4-chlorophenyl)-1-piperazin-1-iumyl]-N-(2-ethoxyphenyl)propanamide IUPAC Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)propanamide Traditional Name: 3-[4-(4-chlorophenyl)piperazin-1-ium-1-yl]-N-o-phenetyl-propionamide Formula: C21H27ClN3O2+ MolecularWeight: 388.91098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CC[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-2-27-20-6-4-3-5-19(20)23-21(26)11-12-24-13-15-25(16-14-24)18-9-7-17(22)8-10-18/h3-10H,2,11-16H2,1H3,(H,23,26)/p+1