3-[[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole

Systemtic Name: 3-[[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]methyl]-5-(2-thienyl)isoxazole Formula: C19H22ClN3OS+2 MolecularWeight: 375.91548

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C19H20ClN3OS/c20-16-5-3-15(4-6-16)13-22-7-9-23(10-8-22)14-17-12-18(24-21-17)19-2-1-11-25-19/h1-6,11-12H,7-10,13-14H2/p+2