tetradecyl 5-nitrothiophene-2-carboxylate

Systemtic Name: tetradecyl 5-nitrothiophene-2-carboxylate Openeye Name: tetradecyl 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid tetradecyl ester IUPAC Name: tetradecyl 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid myristyl ester Formula: C19H31NO4S MolecularWeight: 369.51874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C1=CC=C(S1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)C1=CC=C(S1)[N+](=O)[O-]

InChI

InChI=1S/C19H31NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-24-19(21)17-14-15-18(25-17)20(22)23/h14-15H,2-13,16H2,1H3