1-oxidanyl-1-[2-[[1-oxidanylidene-2-(pyridin-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea

Systemtic Name: 1-oxidanyl-1-[2-[[1-oxidanylidene-2-(pyridin-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Openeye Name: 1-hydroxy-1-[2-[[1-oxo-2-(2-pyridylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea CAS Name: 1-hydroxy-1-[2-[[1-oxo-2-(2-pyridinylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea IUPAC Name: 1-hydroxy-1-[2-[[1-oxo-2-(pyridin-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Traditional Name: 1-hydroxy-1-[2-[[1-keto-2-(2-pyridylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CC3=CC=CC=N3

Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CC3=CC=CC=N3

InChI

InChI=1S/C18H20N4O4/c19-18(24)22(25)9-10-26-15-4-5-16-13(11-15)6-8-21(17(16)23)12-14-3-1-2-7-20-14/h1-5,7,11,25H,6,8-10,12H2,(H2,19,24)