2-[4-[3-(5-phenylfuran-2-yl)propanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[3-(5-phenylfuran-2-yl)propanoyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[3-(5-phenyl-2-furyl)propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[1-oxo-3-(5-phenyl-2-furanyl)propyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[3-(5-phenylfuran-2-yl)propanoyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[3-(5-phenyl-2-furyl)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C22H30N3O3+ MolecularWeight: 384.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CCC2=CC=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CCC2=CC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3/c1-17(2)23-21(26)16-24-12-14-25(15-13-24)22(27)11-9-19-8-10-20(28-19)18-6-4-3-5-7-18/h3-8,10,17H,9,11-16H2,1-2H3,(H,23,26)/p+1