5-[2-[4-[(2S)-butan-2-yl]phenoxy]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[2-[4-[(2S)-butan-2-yl]phenoxy]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: 5-[[2-[4-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[4-[(2S)-butan-2-yl]phenoxy]-1-oxoethyl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[[2-[4-[(2S)-butan-2-yl]phenoxy]acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[4-[(1S)-1-methylpropyl]phenoxy]acetyl]amino]isophthalate Formula: C20H19NO6-2 MolecularWeight: 369.36796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H21NO6/c1-3-12(2)13-4-6-17(7-5-13)27-11-18(22)21-16-9-14(19(23)24)8-15(10-16)20(25)26/h4-10,12H,3,11H2,1-2H3,(H,21,22)(H,23,24)(H,25,26)/p-2/t12-/m0/s1