(2E)-5-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-[ethoxy(oxidanyl)methylidene]-1H-benzo[f][1,4]benzothiazin-6-one

Systemtic Name: (2E)-5-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-[ethoxy(oxidanyl)methylidene]-1H-benzo[f][1,4]benzothiazin-6-one Openeye Name: (2E)-5-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-[ethoxy(hydroxy)methylene]-1H-benzo[f][1,4]benzothiazin-6-one CAS Name: (2E)-5-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-2-[ethoxy(hydroxy)methylidene]-1H-benzo[f][1,4]benzothiazin-6-one IUPAC Name: (2E)-5-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2-[ethoxy(hydroxy)methylidene]-1H-benzo[f][1,4]benzothiazin-6-one Traditional Name: (2E)-5-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-[ethoxy(hydroxy)methylene]-1H-benzo[f][1,4]benzothiazin-6-one Formula: C29H33NO4S MolecularWeight: 491.64162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1CSC2=C(N1)C3=CC=CC=C3C(=O)C2=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)O

Isomeric SMILES

CCO/C(=C/1\CSC2=C(N1)C3=CC=CC=C3C(=O)C2=C4C=C(C(=O)C(=C4)C(C)(C)C)C(C)(C)C)/O

InChI

InChI=1S/C29H33NO4S/c1-8-34-27(33)21-15-35-26-22(24(31)18-12-10-9-11-17(18)23(26)30-21)16-13-19(28(2,3)4)25(32)20(14-16)29(5,6)7/h9-14,30,33H,8,15H2,1-7H3/b27-21+