[6-chloranyl-4-(2,2-dimethylbutanoyloxy)-2,3-di(propan-2-yloxy)naphthalen-1-yl] octanoate

Systemtic Name: [6-chloranyl-4-(2,2-dimethylbutanoyloxy)-2,3-di(propan-2-yloxy)naphthalen-1-yl] octanoate Openeye Name: [6-chloro-4-(2,2-dimethylbutanoyloxy)-2,3-diisopropoxy-1-naphthyl] octanoate CAS Name: octanoic acid [6-chloro-4-(2,2-dimethyl-1-oxobutoxy)-2,3-di(propan-2-yloxy)-1-naphthalenyl] ester IUPAC Name: [6-chloro-4-(2,2-dimethylbutanoyloxy)-2,3-di(propan-2-yloxy)naphthalen-1-yl] octanoate Traditional Name: caprylic acid [6-chloro-4-(2,2-dimethylbutanoyloxy)-2,3-diisopropoxy-1-naphthyl] ester Formula: C30H43ClO6 MolecularWeight: 535.11182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H43ClO6/c1-9-11-12-13-14-15-24(32)36-25-22-17-16-21(31)18-23(22)26(37-29(33)30(7,8)10-2)28(35-20(5)6)27(25)34-19(3)4/h16-20H,9-15H2,1-8H3