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[4-[4-(1-butoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate

Systemtic Name:	[4-[4-(1-butoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
Openeye Name:	[4-[4-(1-butoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
CAS Name:	4-pentadecylbenzoic acid [4-[4-(1-butoxyethyl)phenyl]phenyl] ester
IUPAC Name:	[4-[4-(1-butoxyethyl)phenyl]phenyl] 4-pentadecylbenzoate
Traditional Name:	4-pentadecylbenzoic acid [4-[4-(1-butoxyethyl)phenyl]phenyl] ester
Formula:	C₄₀H₅₆O₃
MolecularWeight:	584.87084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

InChI

InChI=1S/C40H56O3/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-34-20-22-38(23-21-34)40(41)43-39-30-28-37(29-31-39)36-26-24-35(25-27-36)33(3)42-32-7-5-2/h20-31,33H,4-19,32H2,1-3H3

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