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1,3-benzothiazol-2-ylmethyl 3-nitrobenzoate

1,3-benzothiazol-2-ylmethyl 3-nitrobenzoate

Systemtic Name:1,3-benzothiazol-2-ylmethyl 3-nitrobenzoate
Openeye Name:1,3-benzothiazol-2-ylmethyl 3-nitrobenzoate
CAS Name:3-nitrobenzoic acid 1,3-benzothiazol-2-ylmethyl ester
IUPAC Name:1,3-benzothiazol-2-ylmethyl 3-nitrobenzoate
Traditional Name:3-nitrobenzoic acid 1,3-benzothiazol-2-ylmethyl ester
Formula: C15H10N2O4S
MolecularWeight: 314.3159
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H10N2O4S/c18-15(10-4-3-5-11(8-10)17(19)20)21-9-14-16-12-6-1-2-7-13(12)22-14/h1-8H,9H2


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