2-(4-nitrophenyl)-N-[(3R,5S)-4-oxidanylidene-1-adamantyl]-3H-imidazo[4,5-c]pyridine-6-carboxamide

Systemtic Name: 2-(4-nitrophenyl)-N-[(3R,5S)-4-oxidanylidene-1-adamantyl]-3H-imidazo[4,5-c]pyridine-6-carboxamide Openeye Name: 2-(4-nitrophenyl)-N-[(3R,5S)-4-oxo-1-adamantyl]-3H-imidazo[4,5-c]pyridine-6-carboxamide CAS Name: 2-(4-nitrophenyl)-N-[(3R,5S)-4-oxo-1-adamantyl]-3H-imidazo[4,5-c]pyridine-6-carboxamide IUPAC Name: 2-(4-nitrophenyl)-N-[(3R,5S)-4-oxo-1-adamantyl]-3H-imidazo[4,5-c]pyridine-6-carboxamide Traditional Name: N-[(3R,5S)-4-keto-1-adamantyl]-2-(4-nitrophenyl)-3H-imidazo[4,5-c]pyridine-6-carboxamide Formula: C23H21N5O4 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3=O)NC(=O)C4=NC=C5C(=C4)N=C(N5)C6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2=O)CC1C3)NC(=O)C4=NC=C5C(=C4)N=C(N5)C6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O4/c29-20-14-5-12-6-15(20)10-23(8-12,9-14)27-22(30)18-7-17-19(11-24-18)26-21(25-17)13-1-3-16(4-2-13)28(31)32/h1-4,7,11-12,14-15H,5-6,8-10H2,(H,25,26)(H,27,30)/t12?,14-,15+,23?