1-oxidanyl-1-[3-[[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea

Systemtic Name: 1-oxidanyl-1-[3-[[1-oxidanylidene-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea Openeye Name: 1-hydroxy-1-[3-[[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea CAS Name: 1-hydroxy-1-[3-[[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea IUPAC Name: 1-hydroxy-1-[3-[[1-oxo-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea Traditional Name: 1-hydroxy-1-[3-[[1-keto-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-7-yl]oxy]propyl]urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=CC(=C2)OCCCN(C(=O)N)O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C2=C1C=CC(=C2)OCCCN(C(=O)N)O)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c23-22(27)25(28)13-5-15-29-19-10-9-18-11-14-24(21(26)20(18)16-19)12-4-8-17-6-2-1-3-7-17/h1-3,6-7,9-10,16,28H,4-5,8,11-15H2,(H2,23,27)