6-(diethylamino)-1-(phenylmethyl)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile

Systemtic Name: 6-(diethylamino)-1-(phenylmethyl)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile Openeye Name: 1-benzyl-6-(diethylamino)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile CAS Name: 6-(diethylamino)-1-(phenylmethyl)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile IUPAC Name: 1-benzyl-6-(diethylamino)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile Traditional Name: 1-benzyl-6-(diethylamino)-2,3-dihydropyrrolo[3,2-c]pyridin-5-ium-7-carbonitrile Formula: C19H23N4+ MolecularWeight: 307.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=[NH+]C=C2CCN(C2=C1C#N)CC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=[NH+]C=C2CCN(C2=C1C#N)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4/c1-3-22(4-2)19-17(12-20)18-16(13-21-19)10-11-23(18)14-15-8-6-5-7-9-15/h5-9,13H,3-4,10-11,14H2,1-2H3/p+1