1-(3-bromophenyl)-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)urea

Systemtic Name: 1-(3-bromophenyl)-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)urea Openeye Name: 1-(3-bromophenyl)-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)urea CAS Name: 1-(3-bromophenyl)-3-(2-cyano-1-spiro[4H-naphthalene-3,1'-cyclopentane]yl)urea IUPAC Name: 1-(3-bromophenyl)-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)urea Traditional Name: 1-(3-bromophenyl)-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclopentane]-1-yl)urea Formula: C22H20BrN3O MolecularWeight: 422.3177

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C(=C2C#N)NC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C(=C2C#N)NC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrN3O/c23-16-7-5-8-17(12-16)25-21(27)26-20-18-9-2-1-6-15(18)13-22(19(20)14-24)10-3-4-11-22/h1-2,5-9,12H,3-4,10-11,13H2,(H2,25,26,27)