(4-butanoyloxy-7-chloranyl-2,3-dimethoxy-naphthalen-1-yl) 2-methylbutanoate

Systemtic Name: (4-butanoyloxy-7-chloranyl-2,3-dimethoxy-naphthalen-1-yl) 2-methylbutanoate Openeye Name: (4-butanoyloxy-7-chloro-2,3-dimethoxy-1-naphthyl) 2-methylbutanoate CAS Name: 2-methylbutanoic acid [7-chloro-2,3-dimethoxy-4-(1-oxobutoxy)-1-naphthalenyl] ester IUPAC Name: (4-butanoyloxy-7-chloro-2,3-dimethoxynaphthalen-1-yl) 2-methylbutanoate Traditional Name: 2-methylbutyric acid (4-butyryloxy-7-chloro-2,3-dimethoxy-1-naphthyl) ester Formula: C21H25ClO6 MolecularWeight: 408.8726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C(C)CC)OC)OC

Isomeric SMILES

CCCC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C(C)CC)OC)OC

InChI

InChI=1S/C21H25ClO6/c1-6-8-16(23)27-17-14-10-9-13(22)11-15(14)18(20(26-5)19(17)25-4)28-21(24)12(3)7-2/h9-12H,6-8H2,1-5H3