1-(1,3-dithiol-2-ylidene)-4-(phenylmethyl)piperazin-1-ium perchlorate

Systemtic Name: 1-(1,3-dithiol-2-ylidene)-4-(phenylmethyl)piperazin-1-ium perchlorate Openeye Name: 1-benzyl-4-(1,3-dithiol-2-ylidene)piperazin-4-ium perchlorate CAS Name: 1-(1,3-dithiol-2-ylidene)-4-(phenylmethyl)piperazin-1-ium perchlorate IUPAC Name: 1-benzyl-4-(1,3-dithiol-2-ylidene)piperazin-4-ium perchlorate Traditional Name: 1-benzyl-4-(1,3-dithiol-2-ylidene)piperazin-4-ium perchlorate Formula: C14H17ClN2O4S2 MolecularWeight: 376.87878

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C2SC=CS2)CCN1CC3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1C[N+](=C2SC=CS2)CCN1CC3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H17N2S2.ClHO4/c1-2-4-13(5-3-1)12-15-6-8-16(9-7-15)14-17-10-11-18-14;2-1(3,4)5/h1-5,10-11H,6-9,12H2;(H,2,3,4,5)/q+1;/p-1