(3E,7E)-4,8,12-trimethyl-1-phosphono-trideca-3,7,11-triene-1-sulfonic acid

Systemtic Name: (3E,7E)-4,8,12-trimethyl-1-phosphono-trideca-3,7,11-triene-1-sulfonic acid Openeye Name: (3E,7E)-4,8,12-trimethyl-1-phosphono-trideca-3,7,11-triene-1-sulfonic acid CAS Name: (3E,7E)-4,8,12-trimethyl-1-phosphono-1-trideca-3,7,11-trienesulfonic acid IUPAC Name: (3E,7E)-4,8,12-trimethyl-1-phosphonotrideca-3,7,11-triene-1-sulfonic acid Traditional Name: (3E,7E)-4,8,12-trimethyl-1-phosphono-trideca-3,7,11-triene-1-sulfonic acid Formula: C16H29O6PS MolecularWeight: 380.436621

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCC(P(=O)(O)O)S(=O)(=O)O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CC(P(=O)(O)O)S(=O)(=O)O)/C)/C)C

InChI

InChI=1S/C16H29O6PS/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16(23(17,18)19)24(20,21)22/h7,9,11,16H,5-6,8,10,12H2,1-4H3,(H2,17,18,19)(H,20,21,22)/b14-9+,15-11+