(2R)-2-(6-methoxynaphthalen-2-yl)-2-piperazin-4-ium-1-yl-ethanenitrile

Systemtic Name: (2R)-2-(6-methoxynaphthalen-2-yl)-2-piperazin-4-ium-1-yl-ethanenitrile Openeye Name: (2R)-2-(6-methoxy-2-naphthyl)-2-piperazin-4-ium-1-yl-acetonitrile CAS Name: (2R)-2-(6-methoxy-2-naphthalenyl)-2-(1-piperazin-4-iumyl)acetonitrile IUPAC Name: (2R)-2-(6-methoxynaphthalen-2-yl)-2-piperazin-4-ium-1-ylacetonitrile Traditional Name: (2R)-2-(6-methoxy-2-naphthyl)-2-piperazin-4-ium-1-yl-acetonitrile Formula: C17H20N3O+ MolecularWeight: 282.3602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C(C#N)N3CC[NH2+]CC3

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)[C@H](C#N)N3CC[NH2+]CC3

InChI

InChI=1S/C17H19N3O/c1-21-16-5-4-13-10-15(3-2-14(13)11-16)17(12-18)20-8-6-19-7-9-20/h2-5,10-11,17,19H,6-9H2,1H3/p+1/t17-/m0/s1