3'-[(3,5-Diaminobenzoyloxy)methyl]-5',5'-diphenylpentane-2',4'-diyl bis(3,5-diaminobenzoate)

SpectraBase Compound ID	HcXExqNaheN
InChI	InChI=1S/C39H40N6O6/c1-22(50-38(47)26-14-30(42)19-31(43)15-26)34(21-49-37(46)25-12-28(40)18-29(41)13-25)36(51-39(48)27-16-32(44)20-33(45)17-27)35(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-20,22,34-36H,21,40-45H2,1H3
InChIKey	OSGNQNPJGJLZHA-UHFFFAOYSA-N Google Search
Mol Weight	688.8 g/mol
Molecular Formula	C39H40N6O6
Exact Mass	688.300933 g/mol

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SpectraBase Spectrum ID	EgrJg6HyYEJ
Name	3'-[(3,5-Diaminobenzoyloxy)methyl]-5',5'-diphenylpentane-2',4'-diyl bis(3,5-diaminobenzoate)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C39H40N6O6
InChI	InChI=1S/C39H40N6O6/c1-22(50-38(47)26-14-30(42)19-31(43)15-26)34(21-49-37(46)25-12-28(40)18-29(41)13-25)36(51-39(48)27-16-32(44)20-33(45)17-27)35(23-8-4-2-5-9-23)24-10-6-3-7-11-24/h2-20,22,34-36H,21,40-45H2,1H3
InChIKey	OSGNQNPJGJLZHA-UHFFFAOYSA-N
Molecular Weight	688.785 g/mol
SMILES	Nc1cc(C(OC(C(COC(c2cc(cc(c2)N)N)=O)C(OC(c2cc(N)cc(c2)N)=O)C(c2ccccc2)c2ccccc2)C)=O)cc(c1)N
SPLASH	splash10-0f79-2900000000-fe72a8fff3e8dc01a036
Source of Spectrum	H-77-1687-25
Synonyms	1-Benzhydryl-3-[(3,5-diaminobenzoyl)oxy]-2-{[(3,5-diaminobenzoyl)oxy]methyl}butyl 3,5-diaminobenzoate
Wiley ID	1414619