lithium 4-oxidanyl-2-[[2-phenyl-4-(pyridin-3-ylmethylamino)phenyl]carbonylamino]butanoate

Systemtic Name: lithium 4-oxidanyl-2-[[2-phenyl-4-(pyridin-3-ylmethylamino)phenyl]carbonylamino]butanoate Openeye Name: lithium 4-hydroxy-2-[[2-phenyl-4-(3-pyridylmethylamino)benzoyl]amino]butanoate CAS Name: lithium 4-hydroxy-2-[[oxo-[2-phenyl-4-(3-pyridinylmethylamino)phenyl]methyl]amino]butanoate IUPAC Name: lithium 4-hydroxy-2-[[2-phenyl-4-(pyridin-3-ylmethylamino)benzoyl]amino]butanoate Traditional Name: lithium 4-hydroxy-2-[[2-phenyl-4-(3-pyridylmethylamino)benzoyl]amino]butyrate Formula: C23H22LiN3O4 MolecularWeight: 411.37948

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1=CC=C(C=C1)C2=C(C=CC(=C2)NCC3=CN=CC=C3)C(=O)NC(CCO)C(=O)[O-]

Isomeric SMILES

[Li+].C1=CC=C(C=C1)C2=C(C=CC(=C2)NCC3=CN=CC=C3)C(=O)NC(CCO)C(=O)[O-]

InChI

InChI=1S/C23H23N3O4.Li/c27-12-10-21(23(29)30)26-22(28)19-9-8-18(25-15-16-5-4-11-24-14-16)13-20(19)17-6-2-1-3-7-17;/h1-9,11,13-14,21,25,27H,10,12,15H2,(H,26,28)(H,29,30);/q;+1/p-1