N-[8-methoxy-5,5,11-tris(oxidanylidene)-6H-benzo[c][1]benzothiepin-1-yl]-2-methyl-2-oxidanyl-propanamide

Systemtic Name: N-[8-methoxy-5,5,11-tris(oxidanylidene)-6H-benzo[c][1]benzothiepin-1-yl]-2-methyl-2-oxidanyl-propanamide Openeye Name: 2-hydroxy-N-(8-methoxy-5,5,11-trioxo-6H-benzo[c][1]benzothiepin-1-yl)-2-methyl-propanamide CAS Name: 2-hydroxy-N-(8-methoxy-5,5,11-trioxo-6H-benzo[c][1]benzothiepin-1-yl)-2-methylpropanamide IUPAC Name: 2-hydroxy-N-(8-methoxy-5,5,11-trioxo-6H-benzo[c][1]benzothiepin-1-yl)-2-methylpropanamide Traditional Name: 2-hydroxy-2-methyl-N-(5,5,11-triketo-8-methoxy-6H-benzo[c][1]benzothiepin-1-yl)propionamide Formula: C19H19NO6S MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=C2C(=CC=C1)S(=O)(=O)CC3=C(C2=O)C=CC(=C3)OC)O

Isomeric SMILES

CC(C)(C(=O)NC1=C2C(=CC=C1)S(=O)(=O)CC3=C(C2=O)C=CC(=C3)OC)O

InChI

InChI=1S/C19H19NO6S/c1-19(2,23)18(22)20-14-5-4-6-15-16(14)17(21)13-8-7-12(26-3)9-11(13)10-27(15,24)25/h4-9,23H,10H2,1-3H3,(H,20,22)