4-chloranyl-N-(3,5-dimethyl-1-adamantyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(3,5-dimethyl-1-adamantyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(3,5-dimethyl-1-adamantyl)-3-nitro-benzamide CAS Name: 4-chloro-N-(3,5-dimethyl-1-adamantyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(3,5-dimethyl-1-adamantyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(3,5-dimethyl-1-adamantyl)-3-nitro-benzamide Formula: C19H23ClN2O3 MolecularWeight: 362.85052

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C19H23ClN2O3/c1-17-6-12-7-18(2,9-17)11-19(8-12,10-17)21-16(23)13-3-4-14(20)15(5-13)22(24)25/h3-5,12H,6-11H2,1-2H3,(H,21,23)