1-oxidanyl-1-[3-[[1-oxidanylidene-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea

Systemtic Name: 1-oxidanyl-1-[3-[[1-oxidanylidene-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea Openeye Name: 1-hydroxy-1-[3-[[1-oxo-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea CAS Name: 1-hydroxy-1-[3-[[1-oxo-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea IUPAC Name: 1-hydroxy-1-[3-[[1-oxo-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea Traditional Name: 1-hydroxy-1-[3-[[1-keto-3-(2-phenylpropyl)-3,4-dihydro-2H-isoquinolin-6-yl]oxy]propyl]urea Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CC2=C(C=CC(=C2)OCCCN(C(=O)N)O)C(=O)N1)C3=CC=CC=C3

Isomeric SMILES

CC(CC1CC2=C(C=CC(=C2)OCCCN(C(=O)N)O)C(=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4/c1-15(16-6-3-2-4-7-16)12-18-13-17-14-19(8-9-20(17)21(26)24-18)29-11-5-10-25(28)22(23)27/h2-4,6-9,14-15,18,28H,5,10-13H2,1H3,(H2,23,27)(H,24,26)