2-[4-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[[5-(3-chlorophenyl)oxazol-2-yl]methyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[5-(3-chlorophenyl)-2-oxazolyl]methyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[[5-(3-chlorophenyl)oxazol-2-yl]methyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C20H26ClN4O2+ MolecularWeight: 389.89904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC3=NC=C(O3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC3=NC=C(O3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H25ClN4O2/c21-17-5-3-4-16(12-17)18-13-22-19(27-18)14-23-8-10-24(11-9-23)15-20(26)25-6-1-2-7-25/h3-5,12-13H,1-2,6-11,14-15H2/p+1