ethyl 6-[(4-methylphenyl)sulfonylamino]-2-(3-pyridin-3-ylpropyl)hexanoate

Systemtic Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-(3-pyridin-3-ylpropyl)hexanoate Openeye Name: ethyl 6-(p-tolylsulfonylamino)-2-[3-(3-pyridyl)propyl]hexanoate CAS Name: 6-[(4-methylphenyl)sulfonylamino]-2-[3-(3-pyridinyl)propyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[(4-methylphenyl)sulfonylamino]-2-(3-pyridin-3-ylpropyl)hexanoate Traditional Name: 2-[3-(3-pyridyl)propyl]-6-(tosylamino)hexanoic acid ethyl ester Formula: C23H32N2O4S MolecularWeight: 432.57618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)CCCC2=CN=CC=C2

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)CCCC2=CN=CC=C2

InChI

InChI=1S/C23H32N2O4S/c1-3-29-23(26)21(11-6-8-20-9-7-16-24-18-20)10-4-5-17-25-30(27,28)22-14-12-19(2)13-15-22/h7,9,12-16,18,21,25H,3-6,8,10-11,17H2,1-2H3