3-methyl-1-oxidanyl-1-[2-[1-oxidanylidene-2-(3-phenylpropyl)isoquinolin-6-yl]oxyethyl]urea

Systemtic Name: 3-methyl-1-oxidanyl-1-[2-[1-oxidanylidene-2-(3-phenylpropyl)isoquinolin-6-yl]oxyethyl]urea Openeye Name: 1-hydroxy-3-methyl-1-[2-[[1-oxo-2-(3-phenylpropyl)-6-isoquinolyl]oxy]ethyl]urea CAS Name: 1-hydroxy-3-methyl-1-[2-[[1-oxo-2-(3-phenylpropyl)-6-isoquinolinyl]oxy]ethyl]urea IUPAC Name: 1-hydroxy-3-methyl-1-[2-[1-oxo-2-(3-phenylpropyl)isoquinolin-6-yl]oxyethyl]urea Traditional Name: 1-hydroxy-1-[2-[[1-keto-2-(3-phenylpropyl)-6-isoquinolyl]oxy]ethyl]-3-methyl-urea Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N(CCOC1=CC2=C(C=C1)C(=O)N(C=C2)CCCC3=CC=CC=C3)O

Isomeric SMILES

CNC(=O)N(CCOC1=CC2=C(C=C1)C(=O)N(C=C2)CCCC3=CC=CC=C3)O

InChI

InChI=1S/C22H25N3O4/c1-23-22(27)25(28)14-15-29-19-9-10-20-18(16-19)11-13-24(21(20)26)12-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-11,13,16,28H,5,8,12,14-15H2,1H3,(H,23,27)