cyclobutyl 2-butyl-3-[4-[3-(dibutylamino)propyl]phenyl]carbonyl-1-benzofuran-5-carboxylate; ethanedioic acid

Systemtic Name: cyclobutyl 2-butyl-3-[4-[3-(dibutylamino)propyl]phenyl]carbonyl-1-benzofuran-5-carboxylate; ethanedioic acid Openeye Name: cyclobutyl 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]benzofuran-5-carboxylate; oxalic acid CAS Name: 2-butyl-3-[[4-[3-(dibutylamino)propyl]phenyl]-oxomethyl]-5-benzofurancarboxylic acid cyclobutyl ester; oxalic acid IUPAC Name: cyclobutyl 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]-1-benzofuran-5-carboxylate; oxalic acid Traditional Name: 2-butyl-3-[4-[3-(dibutylamino)propyl]benzoyl]benzofuran-5-carboxylic acid cyclobutyl ester; oxalic acid Formula: C37H49NO8 MolecularWeight: 635.78686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC3CCC3)C(=O)C4=CC=C(C=C4)CCCN(CCCC)CCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC3CCC3)C(=O)C4=CC=C(C=C4)CCCN(CCCC)CCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C35H47NO4.C2H2O4/c1-4-7-15-32-33(30-25-28(20-21-31(30)40-32)35(38)39-29-13-10-14-29)34(37)27-18-16-26(17-19-27)12-11-24-36(22-8-5-2)23-9-6-3;3-1(4)2(5)6/h16-21,25,29H,4-15,22-24H2,1-3H3;(H,3,4)(H,5,6)