[4-(phenoxymethyl)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [4-(phenoxymethyl)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [4-(phenoxymethyl)phenyl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [4-(phenoxymethyl)phenyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [4-(phenoxymethyl)phenyl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [4-(phenoxymethyl)phenyl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C23H25N2O2S+ MolecularWeight: 393.5218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=C(C=C3)COC4=CC=CC=C4

InChI

InChI=1S/C23H24N2O2S/c26-23(25-14-12-24(13-15-25)17-22-7-4-16-28-22)20-10-8-19(9-11-20)18-27-21-5-2-1-3-6-21/h1-11,16H,12-15,17-18H2/p+1