2-[4-[(E)-3-[5-(2-azanylethoxy)-2-phenylmethoxy-phenyl]prop-2-enoyl]-2-ethoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(E)-3-[5-(2-azanylethoxy)-2-phenylmethoxy-phenyl]prop-2-enoyl]-2-ethoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(E)-3-[5-(2-aminoethoxy)-2-benzyloxy-phenyl]prop-2-enoyl]-2-ethoxy-phenoxy]acetic acid CAS Name: 2-[4-[(E)-3-[5-(2-aminoethoxy)-2-phenylmethoxyphenyl]-1-oxoprop-2-enyl]-2-ethoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(E)-3-[5-(2-aminoethoxy)-2-phenylmethoxyphenyl]prop-2-enoyl]-2-ethoxyphenoxy]acetic acid Traditional Name: 2-[4-[(E)-3-[5-(2-aminoethoxy)-2-benzoxy-phenyl]acryloyl]-2-ethoxy-phenoxy]acetic acid Formula: C28H29NO7 MolecularWeight: 491.53236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)C=CC2=C(C=CC(=C2)OCCN)OCC3=CC=CC=C3)OCC(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)/C=C/C2=C(C=CC(=C2)OCCN)OCC3=CC=CC=C3)OCC(=O)O

InChI

InChI=1S/C28H29NO7/c1-2-33-27-17-21(9-12-26(27)36-19-28(31)32)24(30)11-8-22-16-23(34-15-14-29)10-13-25(22)35-18-20-6-4-3-5-7-20/h3-13,16-17H,2,14-15,18-19,29H2,1H3,(H,31,32)/b11-8+