1-[2-(4-azanyl-3-nitro-phenyl)ethyl]piperidin-4-one

Systemtic Name: 1-[2-(4-azanyl-3-nitro-phenyl)ethyl]piperidin-4-one Openeye Name: 1-[2-(4-amino-3-nitro-phenyl)ethyl]piperidin-4-one CAS Name: 1-[2-(4-amino-3-nitrophenyl)ethyl]-4-piperidinone IUPAC Name: 1-[2-(4-amino-3-nitrophenyl)ethyl]piperidin-4-one Traditional Name: 1-[2-(4-amino-3-nitro-phenyl)ethyl]-4-piperidone Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)CCC2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1=O)CCC2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c14-12-2-1-10(9-13(12)16(18)19)3-6-15-7-4-11(17)5-8-15/h1-2,9H,3-8,14H2