3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole

Systemtic Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-(2-thienyl)isoxazole Formula: C19H22N3O2S+ MolecularWeight: 356.46188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O2S/c1-23-17-5-2-4-16(13-17)22-9-7-21(8-10-22)14-15-12-18(24-20-15)19-6-3-11-25-19/h2-6,11-13H,7-10,14H2,1H3/p+1