4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoic acid

Systemtic Name: 4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoic acid Openeye Name: 4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxy-phenyl]prop-2-enoyl]benzoic acid CAS Name: 4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxyphenyl]-1-oxoprop-2-enyl]benzoic acid IUPAC Name: 4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxyphenyl]prop-2-enoyl]benzoic acid Traditional Name: 4-[2-[5-(2-cyclopropyl-1H-imidazol-5-yl)-2,4-dimethoxy-phenyl]acryloyl]benzoic acid Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CN=C(N2)C3CC3)C(=C)C(=O)C4=CC=C(C=C4)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=CN=C(N2)C3CC3)C(=C)C(=O)C4=CC=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C24H22N2O5/c1-13(22(27)14-4-8-16(9-5-14)24(28)29)17-10-18(21(31-3)11-20(17)30-2)19-12-25-23(26-19)15-6-7-15/h4-5,8-12,15H,1,6-7H2,2-3H3,(H,25,26)(H,28,29)