butyl 4-undecan-3-ylbenzenesulfonate

Systemtic Name: butyl 4-undecan-3-ylbenzenesulfonate Openeye Name: butyl 4-(1-ethylnonyl)benzenesulfonate CAS Name: 4-undecan-3-ylbenzenesulfonic acid butyl ester IUPAC Name: butyl 4-undecan-3-ylbenzenesulfonate Traditional Name: 4-(1-ethylnonyl)benzenesulfonic acid butyl ester Formula: C21H36O3S MolecularWeight: 368.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)OCCCC

Isomeric SMILES

CCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)OCCCC

InChI

InChI=1S/C21H36O3S/c1-4-7-9-10-11-12-13-19(6-3)20-14-16-21(17-15-20)25(22,23)24-18-8-5-2/h14-17,19H,4-13,18H2,1-3H3