3-(azocan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride

Systemtic Name: 3-(azocan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride Openeye Name: 3-(azocan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride CAS Name: 3-(1-azocanyl)-1-(3-nitrophenyl)-1-propanone hydrochloride IUPAC Name: 3-(azocan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride Traditional Name: 3-(azocan-1-yl)-1-(3-nitrophenyl)propan-1-one hydrochloride Formula: C16H23ClN2O3 MolecularWeight: 326.81842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C1CCCN(CCC1)CCC(=O)C2=CC(=CC=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H22N2O3.ClH/c19-16(14-7-6-8-15(13-14)18(20)21)9-12-17-10-4-2-1-3-5-11-17;/h6-8,13H,1-5,9-12H2;1H