(2-pentadecoxyphenyl) 4-(1-propoxyethyl)benzoate

Systemtic Name: (2-pentadecoxyphenyl) 4-(1-propoxyethyl)benzoate Openeye Name: (2-pentadecoxyphenyl) 4-(1-propoxyethyl)benzoate CAS Name: 4-(1-propoxyethyl)benzoic acid (2-pentadecoxyphenyl) ester IUPAC Name: (2-pentadecoxyphenyl) 4-(1-propoxyethyl)benzoate Traditional Name: 4-(1-propoxyethyl)benzoic acid (2-pentadecoxyphenyl) ester Formula: C33H50O4 MolecularWeight: 510.7477

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCC

InChI

InChI=1S/C33H50O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-19-27-36-31-20-17-18-21-32(31)37-33(34)30-24-22-29(23-25-30)28(3)35-26-5-2/h17-18,20-25,28H,4-16,19,26-27H2,1-3H3