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

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 4-[(3,5-dimethylisoxazol-4-yl)methoxy]-3-methoxy-benzoate CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)methoxy]-3-methoxybenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxybenzoate Traditional Name: 4-[(3,5-dimethylisoxazol-4-yl)methoxy]-3-methoxy-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C21H28N2O6 MolecularWeight: 404.45682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C=C1)OCC2=C(ON=C2C)C)OC

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C=C1)OCC2=C(ON=C2C)C)OC

InChI

InChI=1S/C21H28N2O6/c1-6-16(7-2)22-20(24)12-28-21(25)15-8-9-18(19(10-15)26-5)27-11-17-13(3)23-29-14(17)4/h8-10,16H,6-7,11-12H2,1-5H3,(H,22,24)