2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-thiophen-2-yl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-thiophen-2-yl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-2-thienyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-2-thiophenyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methylthiophen-2-yl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(3-carbethoxy-5-carbomethoxy-4-methyl-2-thienyl)iminomethyl]-4-nitro-phenolate Formula: C17H15N2O7S- MolecularWeight: 391.3752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O7S/c1-4-26-16(21)13-9(2)14(17(22)25-3)27-15(13)18-8-10-7-11(19(23)24)5-6-12(10)20/h5-8,20H,4H2,1-3H3/p-1