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

Systemtic Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)iminomethyl]-6-methyl-4-nitro-phenolate Openeye Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thienyl)iminomethyl]-6-methyl-4-nitro-phenolate CAS Name: 2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)iminomethyl]-6-methyl-4-nitrophenolate IUPAC Name: 2-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)iminomethyl]-6-methyl-4-nitrophenolate Traditional Name: 2-[(3-carbethoxy-4,5-dimethyl-2-thienyl)iminomethyl]-6-methyl-4-nitro-phenolate Formula: C17H17N2O5S- MolecularWeight: 361.39228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-5-24-17(21)14-10(3)11(4)25-16(14)18-8-12-7-13(19(22)23)6-9(2)15(12)20/h6-8,20H,5H2,1-4H3/p-1