ethyl 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonyl-amino]heptanoate

Systemtic Name: ethyl 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonyl-amino]heptanoate Openeye Name: ethyl 7-[[(E)-3-(3-hydroxyphenyl)allyl]-methylsulfonyl-amino]heptanoate CAS Name: 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonylamino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[[(E)-3-(3-hydroxyphenyl)prop-2-enyl]-methylsulfonylamino]heptanoate Traditional Name: 7-[[(E)-3-(3-hydroxyphenyl)allyl]-mesyl-amino]enanthic acid ethyl ester Formula: C19H29NO5S MolecularWeight: 383.50226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN(CC=CC1=CC(=CC=C1)O)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCN(C/C=C/C1=CC(=CC=C1)O)S(=O)(=O)C

InChI

InChI=1S/C19H29NO5S/c1-3-25-19(22)13-6-4-5-7-14-20(26(2,23)24)15-9-11-17-10-8-12-18(21)16-17/h8-12,16,21H,3-7,13-15H2,1-2H3/b11-9+