3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one chloride

Systemtic Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one chloride Openeye Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one chloride CAS Name: 3-(1-azepanyl)-1-(3-nitrophenyl)-1-propanone chloride IUPAC Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one chloride Traditional Name: 3-(azepan-1-yl)-1-(3-nitrophenyl)propan-1-one chloride Formula: C15H20ClN2O3- MolecularWeight: 311.7839

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O3.ClH/c18-15(8-11-16-9-3-1-2-4-10-16)13-6-5-7-14(12-13)17(19)20;/h5-7,12H,1-4,8-11H2;1H/p-1