4-bromanyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[(6-ethoxy-1,3-benzothiazol-2-yl)iminomethyl]-6-nitro-phenolate Formula: C16H11BrN3O4S- MolecularWeight: 421.24524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C16H12BrN3O4S/c1-2-24-11-3-4-12-14(7-11)25-16(19-12)18-8-9-5-10(17)6-13(15(9)21)20(22)23/h3-8,21H,2H2,1H3/p-1