N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-oxidanylidene-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide

Systemtic Name: N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-oxidanylidene-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide Openeye Name: N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-oxo-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide CAS Name: N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-oxo-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide IUPAC Name: N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-oxo-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide Traditional Name: N-tert-butyl-N-(2-hydroxyethyl)-2-[(5-keto-2,3-dihydro-4,1-benzoxathiepin-3-yl)methyl]benzamide Formula: C23H27NO4S MolecularWeight: 413.52978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CCO)C(=O)C1=CC=CC=C1CC2CSC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC(C)(C)N(CCO)C(=O)C1=CC=CC=C1CC2CSC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C23H27NO4S/c1-23(2,3)24(12-13-25)21(26)18-9-5-4-8-16(18)14-17-15-29-20-11-7-6-10-19(20)22(27)28-17/h4-11,17,25H,12-15H2,1-3H3