1-(azepan-1-yl)-2-(2-nitrophenoxy)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(2-nitrophenoxy)propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(2-nitrophenoxy)propan-1-one CAS Name: 1-(1-azepanyl)-2-(2-nitrophenoxy)-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(2-nitrophenoxy)propan-1-one Traditional Name: 1-(azepan-1-yl)-2-(2-nitrophenoxy)propan-1-one Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O4/c1-12(15(18)16-10-6-2-3-7-11-16)21-14-9-5-4-8-13(14)17(19)20/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3