N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonylcyclohexanecarboxamide

Systemtic Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonylcyclohexanecarboxamide Openeye Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonylcyclohexanecarboxamide CAS Name: N-[4-(1-adamantylmethylamino)-3-nitrophenyl]sulfonylcyclohexanecarboxamide IUPAC Name: N-[4-(1-adamantylmethylamino)-3-nitrophenyl]sulfonylcyclohexanecarboxamide Traditional Name: N-[4-(1-adamantylmethylamino)-3-nitro-phenyl]sulfonylcyclohexanecarboxamide Formula: C24H33N3O5S MolecularWeight: 475.60092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NS(=O)(=O)C2=CC(=C(C=C2)NCC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)NS(=O)(=O)C2=CC(=C(C=C2)NCC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C24H33N3O5S/c28-23(19-4-2-1-3-5-19)26-33(31,32)20-6-7-21(22(11-20)27(29)30)25-15-24-12-16-8-17(13-24)10-18(9-16)14-24/h6-7,11,16-19,25H,1-5,8-10,12-15H2,(H,26,28)