N-[4-(1-adamantyl)phenyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[4-(1-adamantyl)phenyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-[4-(1-adamantyl)phenyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-[4-(1-adamantyl)phenyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-[4-(1-adamantyl)phenyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: [4-(1-adamantyl)phenyl]-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O2/c1-23-12-21-18(24(25)26)19(23)22-17-4-2-16(3-5-17)20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,12-15,22H,6-11H2,1H3