2-[[(E)-3-(4-cyclohexylphenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoic acid

Systemtic Name: 2-[[(E)-3-(4-cyclohexylphenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoic acid Openeye Name: 2-[[(E)-3-(4-cyclohexylphenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoic acid CAS Name: 2-[[(E)-3-(4-cyclohexylphenyl)-1-oxobut-2-enyl]amino]-4,5-dimethoxybenzoic acid IUPAC Name: 2-[[(E)-3-(4-cyclohexylphenyl)but-2-enoyl]amino]-4,5-dimethoxybenzoic acid Traditional Name: 2-[[(E)-3-(4-cyclohexylphenyl)but-2-enoyl]amino]-4,5-dimethoxy-benzoic acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=CC(=C(C=C1C(=O)O)OC)OC)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

C/C(=C\C(=O)NC1=CC(=C(C=C1C(=O)O)OC)OC)/C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C25H29NO5/c1-16(17-9-11-19(12-10-17)18-7-5-4-6-8-18)13-24(27)26-21-15-23(31-3)22(30-2)14-20(21)25(28)29/h9-15,18H,4-8H2,1-3H3,(H,26,27)(H,28,29)/b16-13+