2-[4-[(4-hydroxyphenyl)methylcarbamoyl]imidazol-1-yl]octanoic acid

Systemtic Name: 2-[4-[(4-hydroxyphenyl)methylcarbamoyl]imidazol-1-yl]octanoic acid Openeye Name: 2-[4-[(4-hydroxyphenyl)methylcarbamoyl]imidazol-1-yl]octanoic acid CAS Name: 2-[4-[[(4-hydroxyphenyl)methylamino]-oxomethyl]-1-imidazolyl]octanoic acid IUPAC Name: 2-[4-[(4-hydroxyphenyl)methylcarbamoyl]imidazol-1-yl]octanoic acid Traditional Name: 2-[4-[(4-hydroxybenzyl)carbamoyl]imidazol-1-yl]caprylic acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)N1C=C(N=C1)C(=O)NCC2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCC(C(=O)O)N1C=C(N=C1)C(=O)NCC2=CC=C(C=C2)O

InChI

InChI=1S/C19H25N3O4/c1-2-3-4-5-6-17(19(25)26)22-12-16(21-13-22)18(24)20-11-14-7-9-15(23)10-8-14/h7-10,12-13,17,23H,2-6,11H2,1H3,(H,20,24)(H,25,26)