morpholin-4-yl-[3-(4-nitrophenyl)-1-adamantyl]methanone

Systemtic Name: morpholin-4-yl-[3-(4-nitrophenyl)-1-adamantyl]methanone Openeye Name: morpholino-[3-(4-nitrophenyl)-1-adamantyl]methanone CAS Name: 4-morpholinyl-[3-(4-nitrophenyl)-1-adamantyl]methanone IUPAC Name: morpholin-4-yl-[3-(4-nitrophenyl)-1-adamantyl]methanone Traditional Name: morpholino-[3-(4-nitrophenyl)-1-adamantyl]methanone Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O4/c24-19(22-5-7-27-8-6-22)21-12-15-9-16(13-21)11-20(10-15,14-21)17-1-3-18(4-2-17)23(25)26/h1-4,15-16H,5-14H2