(2-azanylimidazol-1-yl) 2-octyl-1-(4-oxidanylphenoxy)pyrrolidine-2-carboxylate

Systemtic Name: (2-azanylimidazol-1-yl) 2-octyl-1-(4-oxidanylphenoxy)pyrrolidine-2-carboxylate Openeye Name: (2-aminoimidazol-1-yl) 1-(4-hydroxyphenoxy)-2-octyl-pyrrolidine-2-carboxylate CAS Name: 1-(4-hydroxyphenoxy)-2-octyl-2-pyrrolidinecarboxylic acid (2-amino-1-imidazolyl) ester IUPAC Name: (2-aminoimidazol-1-yl) 1-(4-hydroxyphenoxy)-2-octylpyrrolidine-2-carboxylate Traditional Name: 1-(4-hydroxyphenoxy)-2-octyl-pyrrolidine-2-carboxylic acid (2-aminoimidazol-1-yl) ester Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CCCN1OC2=CC=C(C=C2)O)C(=O)ON3C=CN=C3N

Isomeric SMILES

CCCCCCCCC1(CCCN1OC2=CC=C(C=C2)O)C(=O)ON3C=CN=C3N

InChI

InChI=1S/C22H32N4O4/c1-2-3-4-5-6-7-13-22(20(28)30-25-17-15-24-21(25)23)14-8-16-26(22)29-19-11-9-18(27)10-12-19/h9-12,15,17,27H,2-8,13-14,16H2,1H3,(H2,23,24)