3-methoxy-4-piperidin-1-ium-4-yloxy-benzenecarbonitrile

Systemtic Name: 3-methoxy-4-piperidin-1-ium-4-yloxy-benzenecarbonitrile Openeye Name: 3-methoxy-4-piperidin-1-ium-4-yloxy-benzonitrile CAS Name: 3-methoxy-4-(4-piperidin-1-iumyloxy)benzonitrile IUPAC Name: 3-methoxy-4-piperidin-1-ium-4-yloxybenzonitrile Traditional Name: 3-methoxy-4-piperidin-1-ium-4-yloxy-benzonitrile Formula: C13H17N2O2+ MolecularWeight: 233.28628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC2CC[NH2+]CC2

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC2CC[NH2+]CC2

InChI

InChI=1S/C13H16N2O2/c1-16-13-8-10(9-14)2-3-12(13)17-11-4-6-15-7-5-11/h2-3,8,11,15H,4-7H2,1H3/p+1