N-(2-methoxy-4-nitro-phenyl)adamantane-1-carboxamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)adamantane-1-carboxamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)adamantane-1-carboxamide CAS Name: N-(2-methoxy-4-nitrophenyl)-1-adamantanecarboxamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)adamantane-1-carboxamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)adamantane-1-carboxamide Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4/c1-24-16-7-14(20(22)23)2-3-15(16)19-17(21)18-8-11-4-12(9-18)6-13(5-11)10-18/h2-3,7,11-13H,4-6,8-10H2,1H3,(H,19,21)