methyl 5-nitro-2-(2-thiophen-2-ylethylamino)benzoate

Systemtic Name: methyl 5-nitro-2-(2-thiophen-2-ylethylamino)benzoate Openeye Name: methyl 5-nitro-2-[2-(2-thienyl)ethylamino]benzoate CAS Name: 5-nitro-2-(2-thiophen-2-ylethylamino)benzoic acid methyl ester IUPAC Name: methyl 5-nitro-2-(2-thiophen-2-ylethylamino)benzoate Traditional Name: 5-nitro-2-[2-(2-thienyl)ethylamino]benzoic acid methyl ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCCC2=CC=CS2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NCCC2=CC=CS2

InChI

InChI=1S/C14H14N2O4S/c1-20-14(17)12-9-10(16(18)19)4-5-13(12)15-7-6-11-3-2-8-21-11/h2-5,8-9,15H,6-7H2,1H3