N-(4-azanyl-3-nitro-phenyl)adamantane-2-carboxamide

Systemtic Name: N-(4-azanyl-3-nitro-phenyl)adamantane-2-carboxamide Openeye Name: N-(4-amino-3-nitro-phenyl)adamantane-2-carboxamide CAS Name: N-(4-amino-3-nitrophenyl)-2-adamantanecarboxamide IUPAC Name: N-(4-amino-3-nitrophenyl)adamantane-2-carboxamide Traditional Name: N-(4-amino-3-nitro-phenyl)adamantane-2-carboxamide Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C(=O)NC4=CC(=C(C=C4)N)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C(=O)NC4=CC(=C(C=C4)N)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O3/c18-14-2-1-13(8-15(14)20(22)23)19-17(21)16-11-4-9-3-10(6-11)7-12(16)5-9/h1-2,8-12,16H,3-7,18H2,(H,19,21)