4-[[(E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid

Systemtic Name: 4-[[(E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid Openeye Name: 4-[[(E)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enoyl]amino]-3-methyl-benzoic acid CAS Name: 4-[[(E)-3-(3-ethoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[(E)-3-(3-ethoxy-4-propoxyphenyl)prop-2-enoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[[(E)-3-(3-ethoxy-4-propoxy-phenyl)acryloyl]amino]-3-methyl-benzoic acid Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=C(C=C2)C(=O)O)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C=C(C=C2)C(=O)O)C)OCC

InChI

InChI=1S/C22H25NO5/c1-4-12-28-19-10-6-16(14-20(19)27-5-2)7-11-21(24)23-18-9-8-17(22(25)26)13-15(18)3/h6-11,13-14H,4-5,12H2,1-3H3,(H,23,24)(H,25,26)/b11-7+