1-pyridin-3-yl-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea

Systemtic Name: 1-pyridin-3-yl-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea Openeye Name: 1-(3-pyridyl)-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea CAS Name: 1-(3-pyridinyl)-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea IUPAC Name: 1-pyridin-3-yl-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea Traditional Name: 1-(3-pyridyl)-3-[2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethyl]urea Formula: C17H21N4O+ MolecularWeight: 297.37484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCNC(=O)NC3=CN=CC=C3

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCNC(=O)NC3=CN=CC=C3

InChI

InChI=1S/C17H20N4O/c22-17(20-16-6-3-8-18-12-16)19-9-11-21-10-7-14-4-1-2-5-15(14)13-21/h1-6,8,12H,7,9-11,13H2,(H2,19,20,22)/p+1