2-dodecoxypropyl 2-[5-(4-butylphenyl)pyridin-2-yl]benzoate

Systemtic Name: 2-dodecoxypropyl 2-[5-(4-butylphenyl)pyridin-2-yl]benzoate Openeye Name: 2-dodecoxypropyl 2-[5-(4-butylphenyl)-2-pyridyl]benzoate CAS Name: 2-[5-(4-butylphenyl)-2-pyridinyl]benzoic acid 2-dodecoxypropyl ester IUPAC Name: 2-dodecoxypropyl 2-[5-(4-butylphenyl)pyridin-2-yl]benzoate Traditional Name: 2-[5-(4-butylphenyl)-2-pyridyl]benzoic acid 2-lauryloxypropyl ester Formula: C37H51NO3 MolecularWeight: 557.80574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)COC(=O)C1=CC=CC=C1C2=NC=C(C=C2)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)COC(=O)C1=CC=CC=C1C2=NC=C(C=C2)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C37H51NO3/c1-4-6-8-9-10-11-12-13-14-17-27-40-30(3)29-41-37(39)35-20-16-15-19-34(35)36-26-25-33(28-38-36)32-23-21-31(22-24-32)18-7-5-2/h15-16,19-26,28,30H,4-14,17-18,27,29H2,1-3H3