[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-butoxy-3-chloranyl-5-methoxy-benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-butoxy-3-chloranyl-5-methoxy-benzoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 4-butoxy-3-chloro-5-methoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-methoxybenzoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 4-butoxy-3-chloro-5-methoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-methoxy-benzoic acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H24ClNO5 MolecularWeight: 369.83986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OC(C)C(=O)NCC=C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)O[C@H](C)C(=O)NCC=C)OC

InChI

InChI=1S/C18H24ClNO5/c1-5-7-9-24-16-14(19)10-13(11-15(16)23-4)18(22)25-12(3)17(21)20-8-6-2/h6,10-12H,2,5,7-9H2,1,3-4H3,(H,20,21)/t12-/m1/s1