[2-(1,3-benzothiazol-2-yl)phenyl] 2-(5-methyl-2-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [2-(1,3-benzothiazol-2-yl)phenyl] 2-(5-methyl-2-propan-2-yl-phenoxy)ethanoate Openeye Name: [2-(1,3-benzothiazol-2-yl)phenyl] 2-(2-isopropyl-5-methyl-phenoxy)acetate CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)acetic acid [2-(1,3-benzothiazol-2-yl)phenyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-yl)phenyl] 2-(5-methyl-2-propan-2-ylphenoxy)acetate Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)acetic acid [2-(1,3-benzothiazol-2-yl)phenyl] ester Formula: C25H23NO3S MolecularWeight: 417.52002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)OC2=CC=CC=C2C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)OC2=CC=CC=C2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23NO3S/c1-16(2)18-13-12-17(3)14-22(18)28-15-24(27)29-21-10-6-4-8-19(21)25-26-20-9-5-7-11-23(20)30-25/h4-14,16H,15H2,1-3H3