1-[2-ethoxy-1-oxidanylidene-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-oxidanyl-urea

Systemtic Name: 1-[2-ethoxy-1-oxidanylidene-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-oxidanyl-urea Openeye Name: 1-[2-ethoxy-1-oxo-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-hydroxy-urea CAS Name: 1-[2-ethoxy-1-oxo-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-hydroxyurea IUPAC Name: 1-[2-ethoxy-1-oxo-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-hydroxyurea Traditional Name: 1-[2-ethoxy-1-keto-2-(3-phenylphenyl)-3,4-dihydroisoquinolin-2-ium-6-yl]-1-hydroxy-urea Formula: C24H24N3O4+ MolecularWeight: 418.46506

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Descriptors Computed from Structure

Canonical SMILES:

CCO[N+]1(CCC2=C(C1=O)C=CC(=C2)N(C(=O)N)O)C3=CC=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCO[N+]1(CCC2=C(C1=O)C=CC(=C2)N(C(=O)N)O)C3=CC=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4/c1-2-31-27(21-10-6-9-18(16-21)17-7-4-3-5-8-17)14-13-19-15-20(26(30)24(25)29)11-12-22(19)23(27)28/h3-12,15-16,30H,2,13-14H2,1H3,(H-,25,29)/p+1