hydrogen sulfate; 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium

Systemtic Name: hydrogen sulfate; 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium Openeye Name: hydrogen sulfate; 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium CAS Name: hydrogen sulfate; 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium IUPAC Name: hydrogen sulfate; 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium Traditional Name: 1-(4-phenyl-1,3-dithiol-2-ylidene)piperidin-1-ium bisulfate Formula: C14H17NO4S3 MolecularWeight: 359.48408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=C2SC=C(S2)C3=CC=CC=C3)CC1.OS(=O)(=O)[O-]

Isomeric SMILES

C1CC[N+](=C2SC=C(S2)C3=CC=CC=C3)CC1.OS(=O)(=O)[O-]

InChI

InChI=1S/C14H16NS2.H2O4S/c1-3-7-12(8-4-1)13-11-16-14(17-13)15-9-5-2-6-10-15;1-5(2,3)4/h1,3-4,7-8,11H,2,5-6,9-10H2;(H2,1,2,3,4)/q+1;/p-1