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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenoxy)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5S/c19-16(10-22-13-7-3-2-6-12(13)18(20)21)23-9-15-17-11-5-1-4-8-14(11)24-15/h1-8H,9-10H2