2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]iminomethyl]-4-methoxy-6-nitro-phenolate

Systemtic Name: 2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]iminomethyl]-4-methoxy-6-nitro-phenolate Openeye Name: 2-[[3-ethoxycarbonyl-4-(p-tolyl)-2-thienyl]iminomethyl]-4-methoxy-6-nitro-phenolate CAS Name: 2-[[3-ethoxycarbonyl-4-(4-methylphenyl)-2-thiophenyl]iminomethyl]-4-methoxy-6-nitrophenolate IUPAC Name: 2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]iminomethyl]-4-methoxy-6-nitrophenolate Traditional Name: 2-[[3-carbethoxy-4-(p-tolyl)-2-thienyl]iminomethyl]-4-methoxy-6-nitro-phenolate Formula: C22H19N2O6S- MolecularWeight: 439.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C22H20N2O6S/c1-4-30-22(26)19-17(14-7-5-13(2)6-8-14)12-31-21(19)23-11-15-9-16(29-3)10-18(20(15)25)24(27)28/h5-12,25H,4H2,1-3H3/p-1