2-[5-chloranyl-2-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,3-benzoxazol-7-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-2-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,3-benzoxazol-7-yl]ethanoic acid Openeye Name: 2-[5-chloro-2-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-1,3-benzoxazol-7-yl]acetic acid CAS Name: 2-[5-chloro-2-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,3-benzoxazol-7-yl]acetic acid IUPAC Name: 2-[5-chloro-2-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,3-benzoxazol-7-yl]acetic acid Traditional Name: 2-[5-chloro-2-[3-(cyclopentoxy)-4-methoxy-benzyl]-1,3-benzoxazol-7-yl]acetic acid Formula: C22H22ClNO5 MolecularWeight: 415.86678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C(=CC(=C3)Cl)CC(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NC3=C(O2)C(=CC(=C3)Cl)CC(=O)O)OC4CCCC4

InChI

InChI=1S/C22H22ClNO5/c1-27-18-7-6-13(8-19(18)28-16-4-2-3-5-16)9-20-24-17-12-15(23)10-14(11-21(25)26)22(17)29-20/h6-8,10,12,16H,2-5,9,11H2,1H3,(H,25,26)