2-[4-(3-oxidanylidene-3-phenyl-propanoyl)phenoxy]ethyl 4-[bis(2-ethylhexyl)amino]benzoate

Systemtic Name: 2-[4-(3-oxidanylidene-3-phenyl-propanoyl)phenoxy]ethyl 4-[bis(2-ethylhexyl)amino]benzoate Openeye Name: 2-[4-(3-oxo-3-phenyl-propanoyl)phenoxy]ethyl 4-[bis(2-ethylhexyl)amino]benzoate CAS Name: 4-[bis(2-ethylhexyl)amino]benzoic acid 2-[4-(1,3-dioxo-3-phenylpropyl)phenoxy]ethyl ester IUPAC Name: 2-[4-(3-oxo-3-phenylpropanoyl)phenoxy]ethyl 4-[bis(2-ethylhexyl)amino]benzoate Traditional Name: 4-[bis(2-ethylhexyl)amino]benzoic acid 2-[4-(3-keto-3-phenyl-propanoyl)phenoxy]ethyl ester Formula: C40H53NO5 MolecularWeight: 627.85252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(CC(CC)CCCC)C1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C(=O)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)CN(CC(CC)CCCC)C1=CC=C(C=C1)C(=O)OCCOC2=CC=C(C=C2)C(=O)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C40H53NO5/c1-5-9-14-31(7-3)29-41(30-32(8-4)15-10-6-2)36-22-18-35(19-23-36)40(44)46-27-26-45-37-24-20-34(21-25-37)39(43)28-38(42)33-16-12-11-13-17-33/h11-13,16-25,31-32H,5-10,14-15,26-30H2,1-4H3