4-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]butanoic acid

Systemtic Name: 4-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]butanoic acid Openeye Name: 4-[3-[2-[[(E)-3-(3-pyridyl)prop-2-enoyl]amino]ethyl]phenoxy]butanoic acid CAS Name: 4-[3-[2-[[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]ethyl]phenoxy]butanoic acid IUPAC Name: 4-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethyl]phenoxy]butanoic acid Traditional Name: 4-[3-[2-[[(E)-3-(3-pyridyl)acryloyl]amino]ethyl]phenoxy]butyric acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCC(=O)O)CCNC(=O)C=CC2=CN=CC=C2

Isomeric SMILES

C1=CC(=CC(=C1)OCCCC(=O)O)CCNC(=O)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C20H22N2O4/c23-19(9-8-17-5-2-11-21-15-17)22-12-10-16-4-1-6-18(14-16)26-13-3-7-20(24)25/h1-2,4-6,8-9,11,14-15H,3,7,10,12-13H2,(H,22,23)(H,24,25)/b9-8+