2-[3-(4-ethoxyphenyl)propyl]-4-methyl-benzenesulfonate

Systemtic Name: 2-[3-(4-ethoxyphenyl)propyl]-4-methyl-benzenesulfonate Openeye Name: 2-[3-(4-ethoxyphenyl)propyl]-4-methyl-benzenesulfonate CAS Name: 2-[3-(4-ethoxyphenyl)propyl]-4-methylbenzenesulfonate IUPAC Name: 2-[3-(4-ethoxyphenyl)propyl]-4-methylbenzenesulfonate Traditional Name: 4-methyl-2-(3-p-phenetylpropyl)besylate Formula: C18H21O4S- MolecularWeight: 333.42194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCCC2=C(C=CC(=C2)C)S(=O)(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)CCCC2=C(C=CC(=C2)C)S(=O)(=O)[O-]

InChI

InChI=1S/C18H22O4S/c1-3-22-17-10-8-15(9-11-17)5-4-6-16-13-14(2)7-12-18(16)23(19,20)21/h7-13H,3-6H2,1-2H3,(H,19,20,21)/p-1