5-(4-methoxy-3-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylic acid

Systemtic Name: 5-(4-methoxy-3-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylic acid Openeye Name: 5-(4-methoxy-3-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylic acid CAS Name: 5-(4-methoxy-3-nitrophenyl)-4-(3,4,5-trimethoxyphenyl)-2-thiophenecarboxylic acid IUPAC Name: 5-(4-methoxy-3-nitrophenyl)-4-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylic acid Traditional Name: 5-(4-methoxy-3-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)-2-thenoic acid Formula: C21H19NO8S MolecularWeight: 445.44246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=C(S2)C(=O)O)C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=C(S2)C(=O)O)C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H19NO8S/c1-27-15-6-5-11(7-14(15)22(25)26)20-13(10-18(31-20)21(23)24)12-8-16(28-2)19(30-4)17(9-12)29-3/h5-10H,1-4H3,(H,23,24)