2-[1-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboximidamide dihydrochloride

Systemtic Name: 2-[1-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboximidamide dihydrochloride Openeye Name: 2-[1-(4-cyano-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboxamidine dihydrochloride CAS Name: 2-[1-(4-cyano-4-piperidinyl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboximidamide dihydrochloride IUPAC Name: 2-[1-(4-cyanopiperidin-4-yl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboximidamide dihydrochloride Traditional Name: 2-[1-(4-cyano-4-piperidyl)ethoxy]-3,4-dihydro-1H-isoquinolin-2-ium-2-carboxamidine dihydrochloride Formula: C18H28Cl2N5O+ MolecularWeight: 401.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CCNCC1)C#N)O[N+]2(CCC3=CC=CC=C3C2)C(=N)N.Cl.Cl

Isomeric SMILES

CC(C1(CCNCC1)C#N)O[N+]2(CCC3=CC=CC=C3C2)C(=N)N.Cl.Cl

InChI

InChI=1S/C18H26N5O.2ClH/c1-14(18(13-19)7-9-22-10-8-18)24-23(17(20)21)11-6-15-4-2-3-5-16(15)12-23;;/h2-5,14,22H,6-12H2,1H3,(H3,20,21);2*1H/q+1;;