calcium 1,2-di(tetradecyl)naphthalene sulfite

Systemtic Name: calcium 1,2-di(tetradecyl)naphthalene sulfite Openeye Name: calcium 1,2-di(tetradecyl)naphthalene sulfite CAS Name: calcium 1,2-di(tetradecyl)naphthalene sulfite IUPAC Name: calcium 1,2-di(tetradecyl)naphthalene sulfite Traditional Name: calcium 1,2-dimyristylnaphthalene sulfite Formula: C38H64CaO3S MolecularWeight: 641.05596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(C2=CC=CC=C2C=C1)CCCCCCCCCCCCCC.[O-]S(=O)[O-].[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(C2=CC=CC=C2C=C1)CCCCCCCCCCCCCC.[O-]S(=O)[O-].[Ca+2]

InChI

InChI=1S/C38H64.Ca.H2O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-35-33-34-36-30-27-28-32-38(36)37(35)31-26-24-22-20-18-16-14-12-10-8-6-4-2;;1-4(2)3/h27-28,30,32-34H,3-26,29,31H2,1-2H3;;(H2,1,2,3)/q;+2;/p-2