1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-dione

Systemtic Name: 1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-dione Openeye Name: 1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-dione CAS Name: 1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-dione IUPAC Name: 1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-dione Traditional Name: 1,1-dimethyl-5,10a-dihydro-3aH-furo[3,4-b][1,5]benzothiazepine-3,4-quinone Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2C(C(=O)NC3=CC=CC=C3S2)C(=O)O1)C

Isomeric SMILES

CC1(C2C(C(=O)NC3=CC=CC=C3S2)C(=O)O1)C

InChI

InChI=1S/C13H13NO3S/c1-13(2)10-9(12(16)17-13)11(15)14-7-5-3-4-6-8(7)18-10/h3-6,9-10H,1-2H3,(H,14,15)