(E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(4-hydroxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(4-hydroxyphenyl)prop-2-enoic acid Openeye Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(4-hydroxyphenyl)prop-2-enoic acid CAS Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]-2-(4-hydroxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-2-(4-hydroxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]-2-(4-hydroxyphenyl)acrylic acid Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C=C(C3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)/C=C(\C3=CC=C(C=C3)O)/C(=O)O

InChI

InChI=1S/C23H23ClN2O3/c1-2-3-8-22-25-14-18(26(22)15-17-6-4-5-7-21(17)24)13-20(23(28)29)16-9-11-19(27)12-10-16/h4-7,9-14,27H,2-3,8,15H2,1H3,(H,28,29)/b20-13+