2-[(2S)-2-ethylpiperidin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(2S)-2-ethylpiperidin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(2S)-2-ethyl-1-piperidyl]-5-nitro-benzonitrile CAS Name: 2-[(2S)-2-ethyl-1-piperidinyl]-5-nitrobenzonitrile IUPAC Name: 2-[(2S)-2-ethylpiperidin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-[(2S)-2-ethylpiperidino]-5-nitro-benzonitrile Formula: C14H17N3O2 MolecularWeight: 259.30368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC[C@H]1CCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H17N3O2/c1-2-12-5-3-4-8-16(12)14-7-6-13(17(18)19)9-11(14)10-15/h6-7,9,12H,2-5,8H2,1H3/t12-/m0/s1