1-[2-chloranyl-4-(4-dodecanoylphenyl)phenoxy]propan-2-yl pentanoate

Systemtic Name: 1-[2-chloranyl-4-(4-dodecanoylphenyl)phenoxy]propan-2-yl pentanoate Openeye Name: [2-[2-chloro-4-(4-dodecanoylphenyl)phenoxy]-1-methyl-ethyl] pentanoate CAS Name: pentanoic acid 1-[2-chloro-4-[4-(1-oxododecyl)phenyl]phenoxy]propan-2-yl ester IUPAC Name: 1-[2-chloro-4-(4-dodecanoylphenyl)phenoxy]propan-2-yl pentanoate Traditional Name: valeric acid [2-[2-chloro-4-(4-lauroylphenyl)phenoxy]-1-methyl-ethyl] ester Formula: C32H45ClO4 MolecularWeight: 529.1503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(C)OC(=O)CCCC)Cl

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OCC(C)OC(=O)CCCC)Cl

InChI

InChI=1S/C32H45ClO4/c1-4-6-8-9-10-11-12-13-14-15-30(34)27-19-17-26(18-20-27)28-21-22-31(29(33)23-28)36-24-25(3)37-32(35)16-7-5-2/h17-23,25H,4-16,24H2,1-3H3