N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]thiophene-2-carboxamide CAS Name: N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(2-adamantyl)-4-[(2-nitrophenoxy)methyl]thiophene-2-carboxamide Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=CS4)COC5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=CS4)COC5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O4S/c25-22(23-21-16-6-13-5-14(8-16)9-17(21)7-13)20-10-15(12-29-20)11-28-19-4-2-1-3-18(19)24(26)27/h1-4,10,12-14,16-17,21H,5-9,11H2,(H,23,25)