5-[[4-(diethylamino)-2-methyl-phenyl]diazenyl]-4-nitro-thiophene-2-carboxylic acid

Systemtic Name: 5-[[4-(diethylamino)-2-methyl-phenyl]diazenyl]-4-nitro-thiophene-2-carboxylic acid Openeye Name: 5-[4-(diethylamino)-2-methyl-phenyl]azo-4-nitro-thiophene-2-carboxylic acid CAS Name: 5-[4-(diethylamino)-2-methylphenyl]azo-4-nitro-2-thiophenecarboxylic acid IUPAC Name: 5-[[4-(diethylamino)-2-methylphenyl]diazenyl]-4-nitrothiophene-2-carboxylic acid Traditional Name: 5-[4-(diethylamino)-2-methyl-phenyl]azo-4-nitro-2-thenoic acid Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(S2)C(=O)O)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N=NC2=C(C=C(S2)C(=O)O)[N+](=O)[O-])C

InChI

InChI=1S/C16H18N4O4S/c1-4-19(5-2)11-6-7-12(10(3)8-11)17-18-15-13(20(23)24)9-14(25-15)16(21)22/h6-9H,4-5H2,1-3H3,(H,21,22)