N-[4-formamido-2,2,3-tris[1-(2-methoxyethyl)-3-oxidanyl-4-oxidanylidene-pyridin-2-yl]butyl]benzamide

Systemtic Name: N-[4-formamido-2,2,3-tris[1-(2-methoxyethyl)-3-oxidanyl-4-oxidanylidene-pyridin-2-yl]butyl]benzamide Openeye Name: N-[4-formamido-2,2,3-tris[3-hydroxy-1-(2-methoxyethyl)-4-oxo-2-pyridyl]butyl]benzamide CAS Name: N-[4-formamido-2,2,3-tris[3-hydroxy-1-(2-methoxyethyl)-4-oxo-2-pyridinyl]butyl]benzamide IUPAC Name: N-[4-formamido-2,2,3-tris[3-hydroxy-1-(2-methoxyethyl)-4-oxopyridin-2-yl]butyl]benzamide Traditional Name: N-[4-formamido-2,2,3-tris[3-hydroxy-4-keto-1-(2-methoxyethyl)-2-pyridyl]butyl]benzamide Formula: C36H43N5O11 MolecularWeight: 721.75352

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC(=O)C(=C1C(CNC=O)C(CNC(=O)C2=CC=CC=C2)(C3=C(C(=O)C=CN3CCOC)O)C4=C(C(=O)C=CN4CCOC)O)O

Isomeric SMILES

COCCN1C=CC(=O)C(=C1C(CNC=O)C(CNC(=O)C2=CC=CC=C2)(C3=C(C(=O)C=CN3CCOC)O)C4=C(C(=O)C=CN4CCOC)O)O

InChI

InChI=1S/C36H43N5O11/c1-50-18-15-39-12-9-26(43)30(46)29(39)25(21-37-23-42)36(22-38-35(49)24-7-5-4-6-8-24,33-31(47)27(44)10-13-40(33)16-19-51-2)34-32(48)28(45)11-14-41(34)17-20-52-3/h4-14,23,25,46-48H,15-22H2,1-3H3,(H,37,42)(H,38,49)