azepan-1-yl-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]methanone

Systemtic Name: azepan-1-yl-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]methanone Openeye Name: azepan-1-yl-[5-[(4-nitropyrazol-1-yl)methyl]-2-furyl]methanone CAS Name: 1-azepanyl-[5-[(4-nitro-1-pyrazolyl)methyl]-2-furanyl]methanone IUPAC Name: azepan-1-yl-[5-[(4-nitropyrazol-1-yl)methyl]furan-2-yl]methanone Traditional Name: azepan-1-yl-[5-[(4-nitropyrazol-1-yl)methyl]-2-furyl]methanone Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(O2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4/c20-15(17-7-3-1-2-4-8-17)14-6-5-13(23-14)11-18-10-12(9-16-18)19(21)22/h5-6,9-10H,1-4,7-8,11H2