2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-imidazole-5-carboxylic acid

Systemtic Name: 2-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-1H-imidazole-5-carboxylic acid Openeye Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-imidazole-5-carboxylic acid CAS Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carboxylic acid IUPAC Name: 2-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1H-imidazole-5-carboxylic acid Traditional Name: 2-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-1H-imidazole-5-carboxylic acid Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC=C(N2)C(=O)O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)C2=NC=C(N2)C(=O)O)O

InChI

InChI=1S/C17H23N3O4/c1-17(2,3)19-8-12(21)10-24-13-6-4-11(5-7-13)15-18-9-14(20-15)16(22)23/h4-7,9,12,19,21H,8,10H2,1-3H3,(H,18,20)(H,22,23)