5-azanyl-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 5-azanyl-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 5-amino-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-4H-isoxazole-5-carboxylic acid CAS Name: 5-amino-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-4H-isoxazole-5-carboxylic acid IUPAC Name: 5-amino-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 5-amino-3-[4-methoxy-3-(5-phenylpentoxy)phenyl]-2-isoxazoline-5-carboxylic acid Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(C2)(C(=O)O)N)OCCCCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(C2)(C(=O)O)N)OCCCCCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O5/c1-27-19-12-11-17(18-15-22(23,21(25)26)29-24-18)14-20(19)28-13-7-3-6-10-16-8-4-2-5-9-16/h2,4-5,8-9,11-12,14H,3,6-7,10,13,15,23H2,1H3,(H,25,26)