1-imidazol-1-yl-3,3-dimethyl-N-[(5-nitrofuran-2-yl)methyl]butan-2-amine

Systemtic Name: 1-imidazol-1-yl-3,3-dimethyl-N-[(5-nitrofuran-2-yl)methyl]butan-2-amine Openeye Name: 1-imidazol-1-yl-3,3-dimethyl-N-[(5-nitro-2-furyl)methyl]butan-2-amine CAS Name: 1-(1-imidazolyl)-3,3-dimethyl-N-[(5-nitro-2-furanyl)methyl]-2-butanamine IUPAC Name: 1-imidazol-1-yl-3,3-dimethyl-N-[(5-nitrofuran-2-yl)methyl]butan-2-amine Traditional Name: [1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-[(5-nitro-2-furyl)methyl]amine Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)NCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(CN1C=CN=C1)NCC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O3/c1-14(2,3)12(9-17-7-6-15-10-17)16-8-11-4-5-13(21-11)18(19)20/h4-7,10,12,16H,8-9H2,1-3H3