2-[[(E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[[(E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[[(E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoyl]amino]thiazole-4-carboxylic acid CAS Name: 2-[[(E)-3-(4-ethoxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-4-thiazolecarboxylic acid IUPAC Name: 2-[[(E)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[[(E)-3-(4-ethoxy-3-methoxy-phenyl)acryloyl]amino]thiazole-4-carboxylic acid Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)NC2=NC(=CS2)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=NC(=CS2)C(=O)O)OC

InChI

InChI=1S/C16H16N2O5S/c1-3-23-12-6-4-10(8-13(12)22-2)5-7-14(19)18-16-17-11(9-24-16)15(20)21/h4-9H,3H2,1-2H3,(H,20,21)(H,17,18,19)/b7-5+