sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoate Openeye Name: sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoate CAS Name: sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: sodium 4-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]benzoate Formula: C18H16NNaO5 MolecularWeight: 349.31311

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)C(=O)[O-])OC.[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)[O-])OC.[Na+]

InChI

InChI=1S/C18H17NO5.Na/c1-23-15-9-3-12(11-16(15)24-2)4-10-17(20)19-14-7-5-13(6-8-14)18(21)22;/h3-11H,1-2H3,(H,19,20)(H,21,22);/q;+1/p-1/b10-4+;