2-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)methyl]-4-nitro-phenolate

Systemtic Name: 2-[(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylcarbonylamino)methyl]-4-nitro-phenolate Openeye Name: 2-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)methyl]-4-nitro-phenolate CAS Name: 2-[[[5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl(oxo)methyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)methyl]-4-nitrophenolate Traditional Name: 2-[(5,6-dihydro-4H-cyclopenta[b]thiophene-2-carbonylamino)methyl]-4-nitro-phenolate Formula: C15H13N2O4S- MolecularWeight: 317.33972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C15H14N2O4S/c18-12-5-4-11(17(20)21)6-10(12)8-16-15(19)14-7-9-2-1-3-13(9)22-14/h4-7,18H,1-3,8H2,(H,16,19)/p-1