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

Systemtic Name: azepan-1-yl-(4-chloranyl-3-nitro-phenyl)methanone Openeye Name: azepan-1-yl-(4-chloro-3-nitro-phenyl)methanone CAS Name: 1-azepanyl-(4-chloro-3-nitrophenyl)methanone IUPAC Name: azepan-1-yl-(4-chloro-3-nitrophenyl)methanone Traditional Name: azepan-1-yl-(4-chloro-3-nitro-phenyl)methanone Formula: C13H15ClN2O3 MolecularWeight: 282.7228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2O3/c14-11-6-5-10(9-12(11)16(18)19)13(17)15-7-3-1-2-4-8-15/h5-6,9H,1-4,7-8H2