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

Systemtic Name: 1-[(2-methyl-3-nitro-phenyl)methyl]piperidin-4-one Openeye Name: 1-[(2-methyl-3-nitro-phenyl)methyl]piperidin-4-one CAS Name: 1-[(2-methyl-3-nitrophenyl)methyl]-4-piperidinone IUPAC Name: 1-[(2-methyl-3-nitrophenyl)methyl]piperidin-4-one Traditional Name: 1-(2-methyl-3-nitro-benzyl)-4-piperidone Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CN2CCC(=O)CC2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CN2CCC(=O)CC2

InChI

InChI=1S/C13H16N2O3/c1-10-11(3-2-4-13(10)15(17)18)9-14-7-5-12(16)6-8-14/h2-4H,5-9H2,1H3