phenylmercury; 3-[(3-sulfonaphthalen-2-yl)methyl]naphthalene-2-sulfonic acid

Systemtic Name: phenylmercury; 3-[(3-sulfonaphthalen-2-yl)methyl]naphthalene-2-sulfonic acid Openeye Name: phenylmercury; 3-[(3-sulfo-2-naphthyl)methyl]naphthalene-2-sulfonic acid CAS Name: phenylmercury; 3-[(3-sulfo-2-naphthalenyl)methyl]-2-naphthalenesulfonic acid IUPAC Name: phenylmercury; 3-[(3-sulfonaphthalen-2-yl)methyl]naphthalene-2-sulfonic acid Traditional Name: phenylmercury; 3-[(3-sulfo-2-naphthyl)methyl]naphthalene-2-sulfonic acid Formula: C33H26Hg2O6S2 MolecularWeight: 983.86594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[Hg].C1=CC=C(C=C1)[Hg].C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=CC=CC=C4C=C3S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)[Hg].C1=CC=C(C=C1)[Hg].C1=CC=C2C=C(C(=CC2=C1)CC3=CC4=CC=CC=C4C=C3S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C21H16O6S2.2C6H5.2Hg/c22-28(23,24)20-12-16-7-3-1-5-14(16)9-18(20)11-19-10-15-6-2-4-8-17(15)13-21(19)29(25,26)27;2*1-2-4-6-5-3-1;;/h1-10,12-13H,11H2,(H,22,23,24)(H,25,26,27);2*1-5H;;