[4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-propoxybenzoate Openeye Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-hexadecoxyethyl)phenyl]phenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[4-(1-cetyloxyethyl)phenyl]phenyl] ester Formula: C40H56O4 MolecularWeight: 600.87024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCC

InChI

InChI=1S/C40H56O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-32-42-33(3)34-19-21-35(22-20-34)36-23-29-39(30-24-36)44-40(41)37-25-27-38(28-26-37)43-31-5-2/h19-30,33H,4-18,31-32H2,1-3H3