3-(4-heptylphenyl)propyl methanesulfonate

Systemtic Name: 3-(4-heptylphenyl)propyl methanesulfonate Openeye Name: 3-(4-heptylphenyl)propyl methanesulfonate CAS Name: methanesulfonic acid 3-(4-heptylphenyl)propyl ester IUPAC Name: 3-(4-heptylphenyl)propyl methanesulfonate Traditional Name: methanesulfonic acid 3-(4-heptylphenyl)propyl ester Formula: C17H28O3S MolecularWeight: 312.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCCOS(=O)(=O)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCCOS(=O)(=O)C

InChI

InChI=1S/C17H28O3S/c1-3-4-5-6-7-9-16-11-13-17(14-12-16)10-8-15-20-21(2,18)19/h11-14H,3-10,15H2,1-2H3