3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitro-phenyl)benzamide

Systemtic Name: 3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitro-phenyl)benzamide Openeye Name: 3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitro-phenyl)benzamide CAS Name: 3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitrophenyl)benzamide IUPAC Name: 3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitrophenyl)benzamide Traditional Name: 3-(1-adamantyl)-4-methoxy-N-(4-methoxy-2-nitro-phenyl)benzamide Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)OC)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N2O5/c1-31-19-4-5-21(22(11-19)27(29)30)26-24(28)18-3-6-23(32-2)20(10-18)25-12-15-7-16(13-25)9-17(8-15)14-25/h3-6,10-11,15-17H,7-9,12-14H2,1-2H3,(H,26,28)