6-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]-3-methyl-1,3-benzothiazol-2-one

Systemtic Name: 6-[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]-3-methyl-1,3-benzothiazol-2-one Openeye Name: 6-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]-3-methyl-1,3-benzothiazol-2-one CAS Name: 6-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]-3-methyl-1,3-benzothiazol-2-one IUPAC Name: 6-[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]-3-methyl-1,3-benzothiazol-2-one Traditional Name: 6-[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]-3-methyl-1,3-benzothiazol-2-one Formula: C25H29NO3S MolecularWeight: 423.56766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)C2=CC3=C(C=C2)N(C(=O)S3)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)C2=CC3=C(C=C2)N(C(=O)S3)C

InChI

InChI=1S/C25H29NO3S/c1-24(2,3)17-12-15(13-18(22(17)28)25(4,5)6)8-11-20(27)16-9-10-19-21(14-16)30-23(29)26(19)7/h8-14,28H,1-7H3/b11-8+