[5-oxidanyl-2-(3-oxidanylidene-3-phenyl-propanoyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate

Systemtic Name: [5-oxidanyl-2-(3-oxidanylidene-3-phenyl-propanoyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate Openeye Name: [5-hydroxy-2-(3-oxo-3-phenyl-propanoyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate CAS Name: 4-[2-ethylhexyl(methyl)amino]benzoic acid [2-(1,3-dioxo-3-phenylpropyl)-5-hydroxyphenyl] ester IUPAC Name: [5-hydroxy-2-(3-oxo-3-phenylpropanoyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate Traditional Name: 4-[2-ethylhexyl(methyl)amino]benzoic acid [5-hydroxy-2-(3-keto-3-phenyl-propanoyl)phenyl] ester Formula: C31H35NO5 MolecularWeight: 501.6133

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)O)C(=O)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)O)C(=O)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C31H35NO5/c1-4-6-10-22(5-2)21-32(3)25-15-13-24(14-16-25)31(36)37-30-19-26(33)17-18-27(30)29(35)20-28(34)23-11-8-7-9-12-23/h7-9,11-19,22,33H,4-6,10,20-21H2,1-3H3