1-[3-chloranyl-4-(2-nitroethanoyl)phenyl]piperidin-2-one

Systemtic Name: 1-[3-chloranyl-4-(2-nitroethanoyl)phenyl]piperidin-2-one Openeye Name: 1-[3-chloro-4-(2-nitroacetyl)phenyl]piperidin-2-one CAS Name: 1-[3-chloro-4-(2-nitro-1-oxoethyl)phenyl]-2-piperidinone IUPAC Name: 1-[3-chloro-4-(2-nitroacetyl)phenyl]piperidin-2-one Traditional Name: 1-[3-chloro-4-(2-nitroacetyl)phenyl]-2-piperidone Formula: C13H13ClN2O4 MolecularWeight: 296.70632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC(=C(C=C2)C(=O)C[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC(=C(C=C2)C(=O)C[N+](=O)[O-])Cl

InChI

InChI=1S/C13H13ClN2O4/c14-11-7-9(15-6-2-1-3-13(15)18)4-5-10(11)12(17)8-16(19)20/h4-5,7H,1-3,6,8H2