3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-dione; yttrium(3+)

Systemtic Name: 3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-dione; yttrium(3+) Openeye Name: 3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-dione; yttrium(3+) CAS Name: 3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-dione; yttrium(3+) IUPAC Name: 3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-dione; yttrium(3+) Traditional Name: 3,4-dimethanidyl-3H-1,4-benzothiazepine-2,5-quinone; yttrium(3+) Formula: C11H9NO2SY+ MolecularWeight: 308.16551

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C1C(=O)SC2=CC=CC=C2C(=O)N1[CH2-].[Y+3]

Isomeric SMILES

[CH2-]C1C(=O)SC2=CC=CC=C2C(=O)N1[CH2-].[Y+3]

InChI

InChI=1S/C11H9NO2S.Y/c1-7-11(14)15-9-6-4-3-5-8(9)10(13)12(7)2;/h3-7H,1-2H2;/q-2;+3