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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC(=O)CCN1)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CC(C1CC(=O)CCN1)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c1-8(12-7-10(17)4-5-15-12)9-2-3-11(14)13(6-9)16(18)19/h2-3,6,8,12,15H,4-5,7,14H2,1H3