1-isoquinolin-5-yl-3-(8-oxidanylspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)urea

Systemtic Name: 1-isoquinolin-5-yl-3-(8-oxidanylspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)urea Openeye Name: 1-(8-hydroxyspiro[chromane-2,1'-cyclobutane]-4-yl)-3-(5-isoquinolyl)urea CAS Name: 1-(8-hydroxy-4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclobutane]yl)-3-(5-isoquinolinyl)urea IUPAC Name: 1-(8-hydroxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)-3-isoquinolin-5-ylurea Traditional Name: 1-(8-hydroxyspiro[chroman-2,1'-cyclobutane]-4-yl)-3-(5-isoquinolyl)urea Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)CC(C3=C(O2)C(=CC=C3)O)NC(=O)NC4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CC2(C1)CC(C3=C(O2)C(=CC=C3)O)NC(=O)NC4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C22H21N3O3/c26-19-7-2-5-16-18(12-22(9-3-10-22)28-20(16)19)25-21(27)24-17-6-1-4-14-13-23-11-8-15(14)17/h1-2,4-8,11,13,18,26H,3,9-10,12H2,(H2,24,25,27)