[4-[(3,5-dimethyl-1,2-oxazol-4-yl)oxycarbonyl]phenyl] 4-decoxybenzoate

Systemtic Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)oxycarbonyl]phenyl] 4-decoxybenzoate Openeye Name: [4-(3,5-dimethylisoxazol-4-yl)oxycarbonylphenyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [4-[(3,5-dimethyl-4-isoxazolyl)oxy-oxomethyl]phenyl] ester IUPAC Name: [4-[(3,5-dimethyl-1,2-oxazol-4-yl)oxycarbonyl]phenyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [4-(3,5-dimethylisoxazol-4-yl)oxycarbonylphenyl] ester Formula: C29H35NO6 MolecularWeight: 493.5913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(ON=C3C)C

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=C(ON=C3C)C

InChI

InChI=1S/C29H35NO6/c1-4-5-6-7-8-9-10-11-20-33-25-16-12-23(13-17-25)28(31)34-26-18-14-24(15-19-26)29(32)35-27-21(2)30-36-22(27)3/h12-19H,4-11,20H2,1-3H3