N-(3-methoxy-5-nitro-phenyl)adamantane-1-carboxamide

Systemtic Name: N-(3-methoxy-5-nitro-phenyl)adamantane-1-carboxamide Openeye Name: N-(3-methoxy-5-nitro-phenyl)adamantane-1-carboxamide CAS Name: N-(3-methoxy-5-nitrophenyl)-1-adamantanecarboxamide IUPAC Name: N-(3-methoxy-5-nitrophenyl)adamantane-1-carboxamide Traditional Name: N-(3-methoxy-5-nitro-phenyl)adamantane-1-carboxamide Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H22N2O4/c1-24-16-6-14(5-15(7-16)20(22)23)19-17(21)18-8-11-2-12(9-18)4-13(3-11)10-18/h5-7,11-13H,2-4,8-10H2,1H3,(H,19,21)