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

Systemtic Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(4-allyloxy-3-methoxy-phenyl)acryloyl]amino]benzoic acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO5/c1-3-12-26-17-10-4-14(13-18(17)25-2)5-11-19(22)21-16-8-6-15(7-9-16)20(23)24/h3-11,13H,1,12H2,2H3,(H,21,22)(H,23,24)/b11-5+