calcium dodecyl (phenylmethyl) sulfate

Systemtic Name: calcium dodecyl (phenylmethyl) sulfate Openeye Name: calcium benzyl dodecyl sulfate CAS Name: calcium sulfuric acid dodecyl (phenylmethyl) ester IUPAC Name: calcium benzyl dodecyl sulfate Traditional Name: calcium sulfuric acid benzyl lauryl ester Formula: C19H32CaO4S+2 MolecularWeight: 396.59798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOS(=O)(=O)OCC1=CC=CC=C1.[Ca+2]

Isomeric SMILES

CCCCCCCCCCCCOS(=O)(=O)OCC1=CC=CC=C1.[Ca+2]

InChI

InChI=1S/C19H32O4S.Ca/c1-2-3-4-5-6-7-8-9-10-14-17-22-24(20,21)23-18-19-15-12-11-13-16-19;/h11-13,15-16H,2-10,14,17-18H2,1H3;/q;+2