[2-(azocan-1-yl)-2-oxidanylidene-ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] 2-[(3,5-dimethylisoxazol-4-yl)methoxy]benzoate CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methoxy]benzoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoate Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methoxy]benzoic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC=CC=C2C(=O)OCC(=O)N3CCCCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC=CC=C2C(=O)OCC(=O)N3CCCCCCC3

InChI

InChI=1S/C22H28N2O5/c1-16-19(17(2)29-23-16)14-27-20-11-7-6-10-18(20)22(26)28-15-21(25)24-12-8-4-3-5-9-13-24/h6-7,10-11H,3-5,8-9,12-15H2,1-2H3