1,3-benzothiazol-2-yl 3-nitrobenzoate

Systemtic Name: 1,3-benzothiazol-2-yl 3-nitrobenzoate Openeye Name: 1,3-benzothiazol-2-yl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid 1,3-benzothiazol-2-yl ester IUPAC Name: 1,3-benzothiazol-2-yl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid 1,3-benzothiazol-2-yl ester Formula: C14H8N2O4S MolecularWeight: 300.28932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8N2O4S/c17-13(9-4-3-5-10(8-9)16(18)19)20-14-15-11-6-1-2-7-12(11)21-14/h1-8H