4-(naphthalen-2-yloxymethyl)-2-phenoxy-3-propyl-benzenesulfonate

Systemtic Name: 4-(naphthalen-2-yloxymethyl)-2-phenoxy-3-propyl-benzenesulfonate Openeye Name: 4-(2-naphthyloxymethyl)-2-phenoxy-3-propyl-benzenesulfonate CAS Name: 4-(2-naphthalenyloxymethyl)-2-phenoxy-3-propylbenzenesulfonate IUPAC Name: 4-(naphthalen-2-yloxymethyl)-2-phenoxy-3-propylbenzenesulfonate Traditional Name: 4-(2-naphthoxymethyl)-2-phenoxy-3-propyl-besylate Formula: C26H23O5S- MolecularWeight: 447.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OC2=CC=CC=C2)S(=O)(=O)[O-])COC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1OC2=CC=CC=C2)S(=O)(=O)[O-])COC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H24O5S/c1-2-8-24-21(18-30-23-15-13-19-9-6-7-10-20(19)17-23)14-16-25(32(27,28)29)26(24)31-22-11-4-3-5-12-22/h3-7,9-17H,2,8,18H2,1H3,(H,27,28,29)/p-1