3-[5-chloranyl-2-(3-cyclopentyloxy-4-methoxy-phenyl)-1,3-benzoxazol-7-yl]prop-2-yn-1-ol

Systemtic Name: 3-[5-chloranyl-2-(3-cyclopentyloxy-4-methoxy-phenyl)-1,3-benzoxazol-7-yl]prop-2-yn-1-ol Openeye Name: 3-[5-chloro-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,3-benzoxazol-7-yl]prop-2-yn-1-ol CAS Name: 3-[5-chloro-2-(3-cyclopentyloxy-4-methoxyphenyl)-1,3-benzoxazol-7-yl]-2-propyn-1-ol IUPAC Name: 3-[5-chloro-2-(3-cyclopentyloxy-4-methoxyphenyl)-1,3-benzoxazol-7-yl]prop-2-yn-1-ol Traditional Name: 3-[5-chloro-2-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,3-benzoxazol-7-yl]prop-2-yn-1-ol Formula: C22H20ClNO4 MolecularWeight: 397.8515

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C(=CC(=C3)Cl)C#CCO)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C(=CC(=C3)Cl)C#CCO)OC4CCCC4

InChI

InChI=1S/C22H20ClNO4/c1-26-19-9-8-15(12-20(19)27-17-6-2-3-7-17)22-24-18-13-16(23)11-14(5-4-10-25)21(18)28-22/h8-9,11-13,17,25H,2-3,6-7,10H2,1H3