N-[3-[2-[(2-nitrophenyl)amino]ethylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[2-[(2-nitrophenyl)amino]ethylamino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-[2-(2-nitroanilino)ethylamino]-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[2-(2-nitroanilino)ethylamino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-(2-nitroanilino)ethylamino]-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-keto-3-[2-(2-nitroanilino)ethylamino]propyl]adamantane-1-carboxamide Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O4/c27-20(24-8-7-23-18-3-1-2-4-19(18)26(29)30)5-6-25-21(28)22-12-15-9-16(13-22)11-17(10-15)14-22/h1-4,15-17,23H,5-14H2,(H,24,27)(H,25,28)