ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-chloranyl-phenoxy]-2-(4-tert-butylphenyl)ethanoate

Systemtic Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-chloranyl-phenoxy]-2-(4-tert-butylphenyl)ethanoate Openeye Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)acetate CAS Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,3-benzoxazol-2-yl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)acetate Traditional Name: 2-[2-(1,3-benzoxazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)acetic acid ethyl ester Formula: C27H26ClNO4 MolecularWeight: 463.95264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C27H26ClNO4/c1-5-31-26(30)24(17-10-12-18(13-11-17)27(2,3)4)32-22-15-14-19(28)16-20(22)25-29-21-8-6-7-9-23(21)33-25/h6-16,24H,5H2,1-4H3