[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl 4-nitrobenzoate Openeye Name: (1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl ester IUPAC Name: (1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (1,1,3-triketo-1,2-benzothiazol-2-yl)methyl ester Formula: C15H10N2O7S MolecularWeight: 362.3141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H10N2O7S/c18-14-12-3-1-2-4-13(12)25(22,23)16(14)9-24-15(19)10-5-7-11(8-6-10)17(20)21/h1-8H,9H2