2,3-bis[[4-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]oxy]butanedioic acid

Systemtic Name: 2,3-bis[[4-butyl-3,5-bis(oxidanylidene)-1,2-diphenyl-pyrazolidin-4-yl]oxy]butanedioic acid Openeye Name: 2,3-bis[(4-butyl-3,5-dioxo-1,2-diphenyl-pyrazolidin-4-yl)oxy]butanedioic acid CAS Name: 2,3-bis[(4-butyl-3,5-dioxo-1,2-diphenyl-4-pyrazolidinyl)oxy]butanedioic acid IUPAC Name: 2,3-bis[(4-butyl-3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)oxy]butanedioic acid Traditional Name: 2,3-bis[(4-butyl-3,5-diketo-1,2-diphenyl-pyrazolidin-4-yl)oxy]succinic acid Formula: C42H42N4O10 MolecularWeight: 762.80368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OC(C(C(=O)O)OC4(C(=O)N(N(C4=O)C5=CC=CC=C5)C6=CC=CC=C6)CCCC)C(=O)O

Isomeric SMILES

CCCCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)OC(C(C(=O)O)OC4(C(=O)N(N(C4=O)C5=CC=CC=C5)C6=CC=CC=C6)CCCC)C(=O)O

InChI

InChI=1S/C42H42N4O10/c1-3-5-27-41(37(51)43(29-19-11-7-12-20-29)44(38(41)52)30-21-13-8-14-22-30)55-33(35(47)48)34(36(49)50)56-42(28-6-4-2)39(53)45(31-23-15-9-16-24-31)46(40(42)54)32-25-17-10-18-26-32/h7-26,33-34H,3-6,27-28H2,1-2H3,(H,47,48)(H,49,50)