2-(1-adamantyl)-N-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-(2-chloro-4-nitro-anilino)ethyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-(2-chloro-4-nitroanilino)ethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-(2-chloro-4-nitroanilino)ethyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-(2-chloro-4-nitro-anilino)ethyl]acetamide Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NCCNC4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NCCNC4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H26ClN3O3/c21-17-8-16(24(26)27)1-2-18(17)22-3-4-23-19(25)12-20-9-13-5-14(10-20)7-15(6-13)11-20/h1-2,8,13-15,22H,3-7,9-12H2,(H,23,25)