(2E)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-4-(methoxymethyl)-1,4-benzothiazin-3-one

Systemtic Name: (2E)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-4-(methoxymethyl)-1,4-benzothiazin-3-one Openeye Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-4-(methoxymethyl)-1,4-benzothiazin-3-one CAS Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4-(methoxymethyl)-1,4-benzothiazin-3-one IUPAC Name: (2E)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4-(methoxymethyl)-1,4-benzothiazin-3-one Traditional Name: (2E)-2-(3,5-ditert-butyl-4-hydroxy-benzylidene)-4-(methoxymethyl)-1,4-benzothiazin-3-one Formula: C25H31NO3S MolecularWeight: 425.58354

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(=O)N(C3=CC=CC=C3S2)COC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/2\C(=O)N(C3=CC=CC=C3S2)COC

InChI

InChI=1S/C25H31NO3S/c1-24(2,3)17-12-16(13-18(22(17)27)25(4,5)6)14-21-23(28)26(15-29-7)19-10-8-9-11-20(19)30-21/h8-14,27H,15H2,1-7H3/b21-14+