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

Systemtic Name: 1,1-dibutyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea Openeye Name: 1,1-dibutyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea CAS Name: 1,1-dibutyl-3-(2-cyano-1-spiro[4H-naphthalene-3,1'-cyclohexane]yl)urea IUPAC Name: 1,1-dibutyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea Traditional Name: 1,1-dibutyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea Formula: C25H35N3O MolecularWeight: 393.5649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C#N

Isomeric SMILES

CCCCN(CCCC)C(=O)NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C#N

InChI

InChI=1S/C25H35N3O/c1-3-5-16-28(17-6-4-2)24(29)27-23-21-13-9-8-12-20(21)18-25(22(23)19-26)14-10-7-11-15-25/h8-9,12-13H,3-7,10-11,14-18H2,1-2H3,(H,27,29)