[4-acetyloxy-7-chloranyl-2,3-bis(2,2-dimethylpropoxy)naphthalen-1-yl] 2-methylbutanoate

Systemtic Name: [4-acetyloxy-7-chloranyl-2,3-bis(2,2-dimethylpropoxy)naphthalen-1-yl] 2-methylbutanoate Openeye Name: [4-acetoxy-7-chloro-2,3-bis(2,2-dimethylpropoxy)-1-naphthyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [4-acetyloxy-7-chloro-2,3-bis(2,2-dimethylpropoxy)-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-7-chloro-2,3-bis(2,2-dimethylpropoxy)naphthalen-1-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid (4-acetoxy-7-chloro-2,3-dineopentyloxy-1-naphthyl) ester Formula: C27H37ClO6 MolecularWeight: 493.03208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC1=C(C(=C(C2=C1C=C(C=C2)Cl)OC(=O)C)OCC(C)(C)C)OCC(C)(C)C

Isomeric SMILES

CCC(C)C(=O)OC1=C(C(=C(C2=C1C=C(C=C2)Cl)OC(=O)C)OCC(C)(C)C)OCC(C)(C)C

InChI

InChI=1S/C27H37ClO6/c1-10-16(2)25(30)34-22-20-13-18(28)11-12-19(20)21(33-17(3)29)23(31-14-26(4,5)6)24(22)32-15-27(7,8)9/h11-13,16H,10,14-15H2,1-9H3