N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(2,6-dinitrophenyl)thiophene-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(2,6-dinitrophenyl)thiophene-2-carboxamide Openeye Name: 5-(2,6-dinitrophenyl)-N-quinuclidin-3-yl-thiophene-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(2,6-dinitrophenyl)-2-thiophenecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-(2,6-dinitrophenyl)thiophene-2-carboxamide Traditional Name: 5-(2,6-dinitrophenyl)-N-quinuclidin-3-yl-thiophene-2-carboxamide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC=C(S3)C4=C(C=CC=C4[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC=C(S3)C4=C(C=CC=C4[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c23-18(19-12-10-20-8-6-11(12)7-9-20)16-5-4-15(28-16)17-13(21(24)25)2-1-3-14(17)22(26)27/h1-5,11-12H,6-10H2,(H,19,23)