2-[4-[[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]phenyl]acetic acid CAS Name: 2-[4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)acryloyl]amino]phenyl]acetic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=C(C=C2)CC(=O)O)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2=CC=C(C=C2)CC(=O)O)OCC=C

InChI

InChI=1S/C21H21NO5/c1-3-12-27-18-10-6-15(13-19(18)26-2)7-11-20(23)22-17-8-4-16(5-9-17)14-21(24)25/h3-11,13H,1,12,14H2,2H3,(H,22,23)(H,24,25)/b11-7+