3-[1-(3-nitrophenyl)propylamino]azepan-2-one

Systemtic Name: 3-[1-(3-nitrophenyl)propylamino]azepan-2-one Openeye Name: 3-[1-(3-nitrophenyl)propylamino]azepan-2-one CAS Name: 3-[1-(3-nitrophenyl)propylamino]-2-azepanone IUPAC Name: 3-[1-(3-nitrophenyl)propylamino]azepan-2-one Traditional Name: 3-[1-(3-nitrophenyl)propylamino]azepan-2-one Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2CCCCNC2=O

Isomeric SMILES

CCC(C1=CC(=CC=C1)[N+](=O)[O-])NC2CCCCNC2=O

InChI

InChI=1S/C15H21N3O3/c1-2-13(11-6-5-7-12(10-11)18(20)21)17-14-8-3-4-9-16-15(14)19/h5-7,10,13-14,17H,2-4,8-9H2,1H3,(H,16,19)