2-ethoxy-3-[4-[2-(prop-2-ynoxycarbonylamino)nonoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-(prop-2-ynoxycarbonylamino)nonoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-(prop-2-ynoxycarbonylamino)nonoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[[oxo(prop-2-ynoxy)methyl]amino]nonoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-(prop-2-ynoxycarbonylamino)nonoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-(propargyloxycarbonylamino)nonoxy]phenyl]propionic acid Formula: C24H35NO6 MolecularWeight: 433.5378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(COC1=CC=C(C=C1)CC(C(=O)O)OCC)NC(=O)OCC#C

Isomeric SMILES

CCCCCCCC(COC1=CC=C(C=C1)CC(C(=O)O)OCC)NC(=O)OCC#C

InChI

InChI=1S/C24H35NO6/c1-4-7-8-9-10-11-20(25-24(28)30-16-5-2)18-31-21-14-12-19(13-15-21)17-22(23(26)27)29-6-3/h2,12-15,20,22H,4,6-11,16-18H2,1,3H3,(H,25,28)(H,26,27)