3-(1-adamantyl)-N-(2-methoxy-5-nitro-phenyl)-3-oxidanylidene-propanamide

Systemtic Name: 3-(1-adamantyl)-N-(2-methoxy-5-nitro-phenyl)-3-oxidanylidene-propanamide Openeye Name: 3-(1-adamantyl)-N-(2-methoxy-5-nitro-phenyl)-3-oxo-propanamide CAS Name: 3-(1-adamantyl)-N-(2-methoxy-5-nitrophenyl)-3-oxopropanamide IUPAC Name: 3-(1-adamantyl)-N-(2-methoxy-5-nitrophenyl)-3-oxopropanamide Traditional Name: 3-(1-adamantyl)-3-keto-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5/c1-27-17-3-2-15(22(25)26)7-16(17)21-19(24)8-18(23)20-9-12-4-13(10-20)6-14(5-12)11-20/h2-3,7,12-14H,4-6,8-11H2,1H3,(H,21,24)