ethanedioic acid; ethyl 3-[3-[3-(dibutylamino)propoxy]phenyl]carbonyl-2-phenyl-indolizine-7-carboxylate

Systemtic Name: ethanedioic acid; ethyl 3-[3-[3-(dibutylamino)propoxy]phenyl]carbonyl-2-phenyl-indolizine-7-carboxylate Openeye Name: ethyl 3-[3-[3-(dibutylamino)propoxy]benzoyl]-2-phenyl-indolizine-7-carboxylate; oxalic acid CAS Name: 3-[[3-[3-(dibutylamino)propoxy]phenyl]-oxomethyl]-2-phenyl-7-indolizinecarboxylic acid ethyl ester; oxalic acid IUPAC Name: ethyl 3-[3-[3-(dibutylamino)propoxy]benzoyl]-2-phenylindolizine-7-carboxylate; oxalic acid Traditional Name: 3-[3-[3-(dibutylamino)propoxy]benzoyl]-2-phenyl-indolizine-7-carboxylic acid ethyl ester; oxalic acid Formula: C37H44N2O8 MolecularWeight: 644.75386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=CC(=C1)C(=O)C2=C(C=C3N2C=CC(=C3)C(=O)OCC)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=CC(=C1)C(=O)C2=C(C=C3N2C=CC(=C3)C(=O)OCC)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C35H42N2O4.C2H2O4/c1-4-7-19-36(20-8-5-2)21-13-23-41-31-17-12-16-28(25-31)34(38)33-32(27-14-10-9-11-15-27)26-30-24-29(18-22-37(30)33)35(39)40-6-3;3-1(4)2(5)6/h9-12,14-18,22,24-26H,4-8,13,19-21,23H2,1-3H3;(H,3,4)(H,5,6)