ethyl 2-[(4-butoxyphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(4-butoxyphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[(4-butoxyphenyl)sulfonyl-(2-pyridylmethyl)amino]acetate CAS Name: 2-[(4-butoxyphenyl)sulfonyl-(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(4-butoxyphenyl)sulfonyl-(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[(4-butoxyphenyl)sulfonyl-(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=N2)CC(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=N2)CC(=O)OCC

InChI

InChI=1S/C20H26N2O5S/c1-3-5-14-27-18-9-11-19(12-10-18)28(24,25)22(16-20(23)26-4-2)15-17-8-6-7-13-21-17/h6-13H,3-5,14-16H2,1-2H3