[2-morpholin-4-yl-1-(4-nitrophenyl)ethyl] adamantane-1-carboxylate

Systemtic Name: [2-morpholin-4-yl-1-(4-nitrophenyl)ethyl] adamantane-1-carboxylate Openeye Name: [2-morpholino-1-(4-nitrophenyl)ethyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-(4-morpholinyl)-1-(4-nitrophenyl)ethyl] ester IUPAC Name: [2-morpholin-4-yl-1-(4-nitrophenyl)ethyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-morpholino-1-(4-nitrophenyl)ethyl] ester Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COCCN1CC(C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H30N2O5/c26-22(23-12-16-9-17(13-23)11-18(10-16)14-23)30-21(15-24-5-7-29-8-6-24)19-1-3-20(4-2-19)25(27)28/h1-4,16-18,21H,5-15H2