[(2R)-2-methylbutyl] 4-[(6-heptadecoxynaphthalen-2-yl)oxymethyl]benzoate

Systemtic Name: [(2R)-2-methylbutyl] 4-[(6-heptadecoxynaphthalen-2-yl)oxymethyl]benzoate Openeye Name: [(2R)-2-methylbutyl] 4-[(6-heptadecoxy-2-naphthyl)oxymethyl]benzoate CAS Name: 4-[(6-heptadecoxy-2-naphthalenyl)oxymethyl]benzoic acid [(2R)-2-methylbutyl] ester IUPAC Name: [(2R)-2-methylbutyl] 4-[(6-heptadecoxynaphthalen-2-yl)oxymethyl]benzoate Traditional Name: 4-[(6-heptadecoxy-2-naphthoxy)methyl]benzoic acid [(2R)-2-methylbutyl] ester Formula: C40H58O4 MolecularWeight: 602.88612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)OCC3=CC=C(C=C3)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)OCC3=CC=C(C=C3)C(=O)OC[C@H](C)CC

InChI

InChI=1S/C40H58O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-28-42-38-26-24-37-30-39(27-25-36(37)29-38)43-32-34-20-22-35(23-21-34)40(41)44-31-33(3)5-2/h20-27,29-30,33H,4-19,28,31-32H2,1-3H3/t33-/m1/s1