2-(3-bromanyl-1-adamantyl)-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[2-(4-nitroanilino)ethyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[2-(4-nitroanilino)ethyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-[2-(4-nitroanilino)ethyl]acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-[2-(4-nitroanilino)ethyl]acetamide Formula: C20H26BrN3O3 MolecularWeight: 436.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NCCNC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NCCNC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H26BrN3O3/c21-20-10-14-7-15(11-20)9-19(8-14,13-20)12-18(25)23-6-5-22-16-1-3-17(4-2-16)24(26)27/h1-4,14-15,22H,5-13H2,(H,23,25)