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

Systemtic Name: N-(1-adamantyl)-N-ethyl-3-methyl-4-nitro-benzamide Openeye Name: N-(1-adamantyl)-N-ethyl-3-methyl-4-nitro-benzamide CAS Name: N-(1-adamantyl)-N-ethyl-3-methyl-4-nitrobenzamide IUPAC Name: N-(1-adamantyl)-N-ethyl-3-methyl-4-nitrobenzamide Traditional Name: N-(1-adamantyl)-N-ethyl-3-methyl-4-nitro-benzamide Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O3/c1-3-21(19(23)17-4-5-18(22(24)25)13(2)6-17)20-10-14-7-15(11-20)9-16(8-14)12-20/h4-6,14-16H,3,7-12H2,1-2H3