N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitro-benzamide

Systemtic Name: N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitro-benzamide Openeye Name: N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitro-benzamide CAS Name: N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitrobenzamide IUPAC Name: N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitrobenzamide Traditional Name: N-(1-adamantyl)-N-ethyl-4-methoxy-3-nitro-benzamide Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O4/c1-3-21(20-10-13-6-14(11-20)8-15(7-13)12-20)19(23)16-4-5-18(26-2)17(9-16)22(24)25/h4-5,9,13-15H,3,6-8,10-12H2,1-2H3