5-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[(E)-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[(E)-3-(3-methoxyphenyl)prop-2-enoyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[(E)-3-(3-methoxyphenyl)acryloyl]amino]isophthalic acid Formula: C18H15NO6 MolecularWeight: 341.3148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO6/c1-25-15-4-2-3-11(7-15)5-6-16(20)19-14-9-12(17(21)22)8-13(10-14)18(23)24/h2-10H,1H3,(H,19,20)(H,21,22)(H,23,24)/b6-5+