azepan-1-yl-(4-nitro-3-oxidanyl-phenyl)methanone

Systemtic Name: azepan-1-yl-(4-nitro-3-oxidanyl-phenyl)methanone Openeye Name: azepan-1-yl-(3-hydroxy-4-nitro-phenyl)methanone CAS Name: 1-azepanyl-(3-hydroxy-4-nitrophenyl)methanone IUPAC Name: azepan-1-yl-(3-hydroxy-4-nitrophenyl)methanone Traditional Name: azepan-1-yl-(3-hydroxy-4-nitro-phenyl)methanone Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O4/c16-12-9-10(5-6-11(12)15(18)19)13(17)14-7-3-1-2-4-8-14/h5-6,9,16H,1-4,7-8H2