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

Systemtic Name: [7-chloranyl-4-hexoxy-2,3-di(propan-2-yloxy)naphthalen-1-yl] octanoate Openeye Name: (7-chloro-4-hexoxy-2,3-diisopropoxy-1-naphthyl) octanoate CAS Name: octanoic acid [7-chloro-4-hexoxy-2,3-di(propan-2-yloxy)-1-naphthalenyl] ester IUPAC Name: [7-chloro-4-hexoxy-2,3-di(propan-2-yloxy)naphthalen-1-yl] octanoate Traditional Name: caprylic acid (7-chloro-4-hexoxy-2,3-diisopropoxy-1-naphthyl) ester Formula: C30H45ClO5 MolecularWeight: 521.1283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H45ClO5/c1-7-9-11-13-14-16-26(32)36-28-25-20-23(31)17-18-24(25)27(33-19-15-12-10-8-2)29(34-21(3)4)30(28)35-22(5)6/h17-18,20-22H,7-16,19H2,1-6H3