N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxy-ethanamide Openeye Name: N-[2-oxo-2-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxy-acetamide CAS Name: N-[2-oxo-2-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]ethyl]-2-phenoxyacetamide IUPAC Name: N-[2-oxo-2-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxyacetamide Traditional Name: N-[2-keto-2-[4-(3-thenyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxy-acetamide Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3S/c23-18(14-25-17-4-2-1-3-5-17)20-12-19(24)22-9-7-21(8-10-22)13-16-6-11-26-15-16/h1-6,11,15H,7-10,12-14H2,(H,20,23)/p+1