1-[(E)-3-chloranylprop-2-enyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid

Systemtic Name: 1-[(E)-3-chloranylprop-2-enyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid Openeye Name: 1-[(E)-3-chloroallyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid CAS Name: 1-[(E)-3-chloroprop-2-enyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid IUPAC Name: 1-[(E)-3-chloroprop-2-enyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid Traditional Name: 1-[(E)-3-chloroallyl]-4-(2-methoxyphenyl)piperazine; sulfuric acid Formula: C14H23ClN2O9S2 MolecularWeight: 462.92342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC=CCl.OS(=O)(=O)O.OS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C/C=C/Cl.OS(=O)(=O)O.OS(=O)(=O)O

InChI

InChI=1S/C14H19ClN2O.2H2O4S/c1-18-14-6-3-2-5-13(14)17-11-9-16(10-12-17)8-4-7-15;2*1-5(2,3)4/h2-7H,8-12H2,1H3;2*(H2,1,2,3,4)/b7-4+;;