[4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl] 4-octoxycarbonyloxybenzoate

Systemtic Name: [4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl] 4-octoxycarbonyloxybenzoate Openeye Name: [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] 4-octoxycarbonyloxybenzoate CAS Name: 4-[octoxy(oxo)methoxy]benzoic acid [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] ester IUPAC Name: [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] 4-octoxycarbonyloxybenzoate Traditional Name: 4-octoxycarbonyloxybenzoic acid [4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl] ester Formula: C33H39BrO6 MolecularWeight: 611.56316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)Br

Isomeric SMILES

CCCCCCCCOC(=O)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)Br

InChI

InChI=1S/C33H39BrO6/c1-4-6-7-8-9-10-21-37-33(36)40-29-18-13-26(14-19-29)32(35)39-28-16-11-25(12-17-28)27-15-20-31(30(34)22-27)38-23-24(3)5-2/h11-20,22,24H,4-10,21,23H2,1-3H3