N-[2-(1-adamantyl)-6-methoxy-3-nitro-phenyl]-3-oxidanylidene-propanamide

Systemtic Name: N-[2-(1-adamantyl)-6-methoxy-3-nitro-phenyl]-3-oxidanylidene-propanamide Openeye Name: N-[2-(1-adamantyl)-6-methoxy-3-nitro-phenyl]-3-oxo-propanamide CAS Name: N-[2-(1-adamantyl)-6-methoxy-3-nitrophenyl]-3-oxopropanamide IUPAC Name: N-[2-(1-adamantyl)-6-methoxy-3-nitrophenyl]-3-oxopropanamide Traditional Name: N-[2-(1-adamantyl)-6-methoxy-3-nitro-phenyl]-3-keto-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-])C23CC4CC(C2)CC(C4)C3)NC(=O)CC=O

Isomeric SMILES

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

InChI

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