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

Systemtic Name: 2-dimethylaminoethyl 2-butyl-3-[4-[3-(dibutylamino)propoxy]phenyl]carbonyl-1-benzofuran-5-carboxylate; ethanedioic acid Openeye Name: 2-dimethylaminoethyl 2-butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]benzofuran-5-carboxylate; oxalic acid CAS Name: 2-butyl-3-[[4-[3-(dibutylamino)propoxy]phenyl]-oxomethyl]-5-benzofurancarboxylic acid 2-dimethylaminoethyl ester; oxalic acid IUPAC Name: 2-dimethylaminoethyl 2-butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]-1-benzofuran-5-carboxylate; oxalic acid Traditional Name: 2-butyl-3-[4-[3-(dibutylamino)propoxy]benzoyl]benzofuran-5-carboxylic acid 2-dimethylaminoethyl ester; oxalic acid Formula: C37H52N2O9 MolecularWeight: 668.81678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OCCN(C)C)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OCCN(C)C)C(=O)C3=CC=C(C=C3)OCCCN(CCCC)CCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C35H50N2O5.C2H2O4/c1-6-9-13-32-33(30-26-28(16-19-31(30)42-32)35(39)41-25-23-36(4)5)34(38)27-14-17-29(18-15-27)40-24-12-22-37(20-10-7-2)21-11-8-3;3-1(4)2(5)6/h14-19,26H,6-13,20-25H2,1-5H3;(H,3,4)(H,5,6)