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

Systemtic Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(6-methoxy-1,3-benzothiazol-2-yl)iminomethyl]-4-nitro-phenolate Formula: C15H10N3O4S- MolecularWeight: 328.3226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C15H11N3O4S/c1-22-11-3-4-12-14(7-11)23-15(17-12)16-8-9-6-10(18(20)21)2-5-13(9)19/h2-8,19H,1H3/p-1