methyl 3-[(2-nitropyrrol-1-yl)methyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-nitropyrrol-1-yl)methyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(2-nitropyrrol-1-yl)methyl]thiophene-2-carboxylate CAS Name: 3-[(2-nitro-1-pyrrolyl)methyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-nitropyrrol-1-yl)methyl]thiophene-2-carboxylate Traditional Name: 3-[(2-nitropyrrol-1-yl)methyl]thiophene-2-carboxylic acid methyl ester Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)CN2C=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CS1)CN2C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O4S/c1-17-11(14)10-8(4-6-18-10)7-12-5-2-3-9(12)13(15)16/h2-6H,7H2,1H3