(Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphono-oct-5-ene-1-sulfonic acid

Systemtic Name: (Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphono-oct-5-ene-1-sulfonic acid Openeye Name: (Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphono-oct-5-ene-1-sulfonic acid CAS Name: (Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphono-5-octene-1-sulfonic acid IUPAC Name: (Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphonooct-5-ene-1-sulfonic acid Traditional Name: (Z)-8-(3-methoxyphenyl)-6-methyl-1-phosphono-oct-5-ene-1-sulfonic acid Formula: C16H25O7PS MolecularWeight: 392.404261

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCCC(P(=O)(O)O)S(=O)(=O)O)CCC1=CC(=CC=C1)OC

Isomeric SMILES

C/C(=C/CCCC(P(=O)(O)O)S(=O)(=O)O)/CCC1=CC(=CC=C1)OC

InChI

InChI=1S/C16H25O7PS/c1-13(10-11-14-7-5-8-15(12-14)23-2)6-3-4-9-16(24(17,18)19)25(20,21)22/h5-8,12,16H,3-4,9-11H2,1-2H3,(H2,17,18,19)(H,20,21,22)/b13-6-