2-[2,3-bis[[4-(2-methylpropyl)phenyl]methylamino]phenyl]carbonyl-2-indolizin-3-yl-butanoic acid

Systemtic Name: 2-[2,3-bis[[4-(2-methylpropyl)phenyl]methylamino]phenyl]carbonyl-2-indolizin-3-yl-butanoic acid Openeye Name: 2-[2,3-bis[(4-isobutylphenyl)methylamino]benzoyl]-2-indolizin-3-yl-butanoic acid CAS Name: 2-[[2,3-bis[[4-(2-methylpropyl)phenyl]methylamino]phenyl]-oxomethyl]-2-(3-indolizinyl)butanoic acid IUPAC Name: 2-[2,3-bis[[4-(2-methylpropyl)phenyl]methylamino]benzoyl]-2-indolizin-3-ylbutanoic acid Traditional Name: 2-[2,3-bis[(4-isobutylbenzyl)amino]benzoyl]-2-indolizin-3-yl-butyric acid Formula: C41H47N3O3 MolecularWeight: 629.83018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C2N1C=CC=C2)(C(=O)C3=C(C(=CC=C3)NCC4=CC=C(C=C4)CC(C)C)NCC5=CC=C(C=C5)CC(C)C)C(=O)O

Isomeric SMILES

CCC(C1=CC=C2N1C=CC=C2)(C(=O)C3=C(C(=CC=C3)NCC4=CC=C(C=C4)CC(C)C)NCC5=CC=C(C=C5)CC(C)C)C(=O)O

InChI

InChI=1S/C41H47N3O3/c1-6-41(40(46)47,37-22-21-34-10-7-8-23-44(34)37)39(45)35-11-9-12-36(42-26-32-17-13-30(14-18-32)24-28(2)3)38(35)43-27-33-19-15-31(16-20-33)25-29(4)5/h7-23,28-29,42-43H,6,24-27H2,1-5H3,(H,46,47)