2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thienyl)iminomethyl]-6-nitro-phenolate CAS Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)iminomethyl]-6-nitrophenolate IUPAC Name: 2-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)iminomethyl]-6-nitrophenolate Traditional Name: 2-[(3-carbethoxy-4,5-dimethyl-2-thienyl)iminomethyl]-6-nitro-phenolate Formula: C16H15N2O5S- MolecularWeight: 347.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)N=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)N=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H16N2O5S/c1-4-23-16(20)13-9(2)10(3)24-15(13)17-8-11-6-5-7-12(14(11)19)18(21)22/h5-8,19H,4H2,1-3H3/p-1