cyclohexanol; 4-heptadecylbenzenesulfonate

Systemtic Name: cyclohexanol; 4-heptadecylbenzenesulfonate Openeye Name: cyclohexanol; 4-heptadecylbenzenesulfonate CAS Name: cyclohexanol; 4-heptadecylbenzenesulfonate IUPAC Name: cyclohexanol; 4-heptadecylbenzenesulfonate Traditional Name: cyclohexanol; 4-heptadecylbesylate Formula: C29H51O4S- MolecularWeight: 495.77784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCC(CC1)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)[O-].C1CCC(CC1)O

InChI

InChI=1S/C23H40O3S.C6H12O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-18-20-23(21-19-22)27(24,25)26;7-6-4-2-1-3-5-6/h18-21H,2-17H2,1H3,(H,24,25,26);6-7H,1-5H2/p-1