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

Systemtic Name: 1-oxidanyl-1-[2-[[1-oxidanylidene-2-(quinolin-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Openeye Name: 1-hydroxy-1-[2-[[1-oxo-2-(2-quinolylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea CAS Name: 1-hydroxy-1-[2-[[1-oxo-2-(2-quinolinylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea IUPAC Name: 1-hydroxy-1-[2-[[1-oxo-2-(quinolin-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Traditional Name: 1-hydroxy-1-[2-[[1-keto-2-(2-quinolylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)OCCN(C(=O)N)O)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H22N4O4/c23-22(28)26(29)11-12-30-18-7-8-19-16(13-18)9-10-25(21(19)27)14-17-6-5-15-3-1-2-4-20(15)24-17/h1-8,13,29H,9-12,14H2,(H2,23,28)