N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(1R)-1-(2-benzofuranyl)ethyl]-2-(4-benzoyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-2-(4-benzoylpiperazin-1-ium-1-yl)acetamide Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=CC2=CC=CC=C2O1)NC(=O)C[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-17(21-15-19-9-5-6-10-20(19)29-21)24-22(27)16-25-11-13-26(14-12-25)23(28)18-7-3-2-4-8-18/h2-10,15,17H,11-14,16H2,1H3,(H,24,27)/p+1/t17-/m1/s1