2-(3-azanylidene-2H-pyridin-2-yl)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-azanylidene-2H-pyridin-2-yl)-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3-imino-2H-pyridin-2-yl)acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3-imino-2H-pyridin-2-yl)acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(3-imino-2H-pyridin-2-yl)acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(3-imino-2H-pyridin-2-yl)acetic acid Formula: C21H28N2O3 MolecularWeight: 356.45862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2C(=N)C=CC=N2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2C(=N)C=CC=N2)C(=O)O

InChI

InChI=1S/C21H28N2O3/c1-20(2,3)13-10-12(11-14(18(13)24)21(4,5)6)16(19(25)26)17-15(22)8-7-9-23-17/h7-11,16-17,22,24H,1-6H3,(H,25,26)