azepan-1-yl-[4-[[(5-nitropyridin-2-yl)amino]methyl]phenyl]methanone

Systemtic Name: azepan-1-yl-[4-[[(5-nitropyridin-2-yl)amino]methyl]phenyl]methanone Openeye Name: azepan-1-yl-[4-[[(5-nitro-2-pyridyl)amino]methyl]phenyl]methanone CAS Name: 1-azepanyl-[4-[[(5-nitro-2-pyridinyl)amino]methyl]phenyl]methanone IUPAC Name: azepan-1-yl-[4-[[(5-nitropyridin-2-yl)amino]methyl]phenyl]methanone Traditional Name: azepan-1-yl-[4-[[(5-nitro-2-pyridyl)amino]methyl]phenyl]methanone Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3/c24-19(22-11-3-1-2-4-12-22)16-7-5-15(6-8-16)13-20-18-10-9-17(14-21-18)23(25)26/h5-10,14H,1-4,11-13H2,(H,20,21)