6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-1-one; 1-methyl-3-oxidanyl-urea

Systemtic Name: 6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-1-one; 1-methyl-3-oxidanyl-urea Openeye Name: 6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-1-one; 1-hydroxy-3-methyl-urea CAS Name: 6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-1-one; 1-hydroxy-3-methylurea IUPAC Name: 6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisoquinolin-1-one; 1-hydroxy-3-methylurea Traditional Name: 6-ethoxy-2-(3-phenylpropyl)-3,4-dihydroisocarbostyril; 1-hydroxy-3-methyl-urea Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=O)N(CC2)CCCC3=CC=CC=C3.CNC(=O)NO

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=O)N(CC2)CCCC3=CC=CC=C3.CNC(=O)NO

InChI

InChI=1S/C20H23NO2.C2H6N2O2/c1-2-23-18-10-11-19-17(15-18)12-14-21(20(19)22)13-6-9-16-7-4-3-5-8-16;1-3-2(5)4-6/h3-5,7-8,10-11,15H,2,6,9,12-14H2,1H3;6H,1H3,(H2,3,4,5)