ethyl 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-(2-pyridylmethyl)amino]acetate CAS Name: 2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=C(C(=C(C=C2C)OC)C)C

InChI

InChI=1S/C20H26N2O5S/c1-6-27-19(23)13-22(12-17-9-7-8-10-21-17)28(24,25)20-14(2)11-18(26-5)15(3)16(20)4/h7-11H,6,12-13H2,1-5H3