N4-[2-(3,4-diethoxyphenyl)ethyl]pyridin-1-ium-3,4-diamine

Systemtic Name: N4-[2-(3,4-diethoxyphenyl)ethyl]pyridin-1-ium-3,4-diamine Openeye Name: N4-[2-(3,4-diethoxyphenyl)ethyl]pyridin-1-ium-3,4-diamine CAS Name: N4-[2-(3,4-diethoxyphenyl)ethyl]pyridin-1-ium-3,4-diamine IUPAC Name: 4-N-[2-(3,4-diethoxyphenyl)ethyl]pyridin-1-ium-3,4-diamine Traditional Name: (3-aminopyridin-1-ium-4-yl)-[2-(3,4-diethoxyphenyl)ethyl]amine Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC2=C(C=[NH+]C=C2)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC2=C(C=[NH+]C=C2)N)OCC

InChI

InChI=1S/C17H23N3O2/c1-3-21-16-6-5-13(11-17(16)22-4-2)7-10-20-15-8-9-19-12-14(15)18/h5-6,8-9,11-12H,3-4,7,10,18H2,1-2H3,(H,19,20)/p+1