1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenyl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenyl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenyl)acetate CAS Name: 2-(2-nitrophenyl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenyl)acetate Traditional Name: 2-(2-nitrophenyl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)OCC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)OCC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O4S/c19-16(9-11-5-1-3-7-13(11)18(20)21)22-10-15-17-12-6-2-4-8-14(12)23-15/h1-8H,9-10H2