(Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxy-pent-3-ene-1-sulfonic acid

Systemtic Name: (Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxy-pent-3-ene-1-sulfonic acid Openeye Name: (Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxy-pent-3-ene-1-sulfonic acid CAS Name: (Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxy-3-pentene-1-sulfonic acid IUPAC Name: (Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxypent-3-ene-1-sulfonic acid Traditional Name: (Z)-2-(1,3-benzoxazol-2-ylmethyl)-4-ethoxy-pent-3-ene-1-sulfonic acid Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=CC(CC1=NC2=CC=CC=C2O1)CS(=O)(=O)O)C

Isomeric SMILES

CCO/C(=C\C(CC1=NC2=CC=CC=C2O1)CS(=O)(=O)O)/C

InChI

InChI=1S/C15H19NO5S/c1-3-20-11(2)8-12(10-22(17,18)19)9-15-16-13-6-4-5-7-14(13)21-15/h4-8,12H,3,9-10H2,1-2H3,(H,17,18,19)/b11-8-