(2R)-2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[4-(2-chlorophenyl)carbonylpiperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)-2-phenyl-ethanamide Openeye Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)-2-phenyl-acetamide CAS Name: (2R)-2-[4-[(2-chlorophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-ethoxyphenyl)-2-phenylacetamide IUPAC Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-(2-ethoxyphenyl)-2-phenylacetamide Traditional Name: (2R)-2-[4-(2-chlorobenzoyl)piperazin-1-ium-1-yl]-N-o-phenetyl-2-phenyl-acetamide Formula: C27H29ClN3O3+ MolecularWeight: 478.99046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@@H](C2=CC=CC=C2)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C27H28ClN3O3/c1-2-34-24-15-9-8-14-23(24)29-26(32)25(20-10-4-3-5-11-20)30-16-18-31(19-17-30)27(33)21-12-6-7-13-22(21)28/h3-15,25H,2,16-19H2,1H3,(H,29,32)/p+1/t25-/m1/s1