methyl 2-(3-phenylpropylsulfonylamino)octanoate

Systemtic Name: methyl 2-(3-phenylpropylsulfonylamino)octanoate Openeye Name: methyl 2-(3-phenylpropylsulfonylamino)octanoate CAS Name: 2-(3-phenylpropylsulfonylamino)octanoic acid methyl ester IUPAC Name: methyl 2-(3-phenylpropylsulfonylamino)octanoate Traditional Name: 2-(3-phenylpropylsulfonylamino)caprylic acid methyl ester Formula: C18H29NO4S MolecularWeight: 355.49216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC)NS(=O)(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(C(=O)OC)NS(=O)(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C18H29NO4S/c1-3-4-5-9-14-17(18(20)23-2)19-24(21,22)15-10-13-16-11-7-6-8-12-16/h6-8,11-12,17,19H,3-5,9-10,13-15H2,1-2H3