[3-ethanoyl-1,1-bis(oxidanylidene)-2-propyl-1$l^{6},2-benzothiazin-4-yl] 4-methoxybenzoate

Systemtic Name: [3-ethanoyl-1,1-bis(oxidanylidene)-2-propyl-1$l^{6},2-benzothiazin-4-yl] 4-methoxybenzoate Openeye Name: (3-acetyl-1,1-dioxo-2-propyl-1$l^{6},2-benzothiazin-4-yl) 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (3-acetyl-1,1-dioxo-2-propyl-1$l^{6},2-benzothiazin-4-yl) ester IUPAC Name: (3-acetyl-1,1-dioxo-2-propyl-1$l^{6},2-benzothiazin-4-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (3-acetyl-1,1-diketo-2-propyl-1$l^{6},2-benzothiazin-4-yl) ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=C(C=C3)OC)C(=O)C

Isomeric SMILES

CCCN1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=C(C=C3)OC)C(=O)C

InChI

InChI=1S/C21H21NO6S/c1-4-13-22-19(14(2)23)20(17-7-5-6-8-18(17)29(22,25)26)28-21(24)15-9-11-16(27-3)12-10-15/h5-12H,4,13H2,1-3H3