N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)-1-pyridin-1-iumyl]acetamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetamide Formula: C21H30N3O3+ MolecularWeight: 372.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)N(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C[N+]2=CC=C(C=C2)N(C)C)OCC

InChI

InChI=1S/C21H29N3O3/c1-5-26-19-8-7-17(15-20(19)27-6-2)9-12-22-21(25)16-24-13-10-18(11-14-24)23(3)4/h7-8,10-11,13-15H,5-6,9,12,16H2,1-4H3/p+1