2-[4-(2-phenylphenyl)carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(2-phenylphenyl)carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(2-phenylbenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[oxo-(2-phenylphenyl)methyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(2-phenylbenzoyl)piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(2-phenylbenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-17(2)23-21(26)16-24-12-14-25(15-13-24)22(27)20-11-7-6-10-19(20)18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3,(H,23,26)/p+1