[2-(2-pentylnonyl)phenyl] hydrogen sulfate

Systemtic Name: [2-(2-pentylnonyl)phenyl] hydrogen sulfate Openeye Name: [2-(2-pentylnonyl)phenyl] hydrogen sulfate CAS Name: sulfuric acid [2-(2-pentylnonyl)phenyl] ester IUPAC Name: [2-(2-pentylnonyl)phenyl] hydrogen sulfate Traditional Name: sulfuric acid [2-(2-amylnonyl)phenyl] ester Formula: C20H34O4S MolecularWeight: 370.54656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCC)CC1=CC=CC=C1OS(=O)(=O)O

Isomeric SMILES

CCCCCCCC(CCCCC)CC1=CC=CC=C1OS(=O)(=O)O

InChI

InChI=1S/C20H34O4S/c1-3-5-7-8-10-14-18(13-9-6-4-2)17-19-15-11-12-16-20(19)24-25(21,22)23/h11-12,15-16,18H,3-10,13-14,17H2,1-2H3,(H,21,22,23)