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

Systemtic Name: 3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)-1,1-bis(phenylmethyl)urea Openeye Name: 1,1-dibenzyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea CAS Name: 3-(2-cyano-1-spiro[4H-naphthalene-3,1'-cyclohexane]yl)-1,1-bis(phenylmethyl)urea IUPAC Name: 1,1-dibenzyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea Traditional Name: 1,1-dibenzyl-3-(2-cyanospiro[4H-naphthalene-3,1'-cyclohexane]-1-yl)urea Formula: C31H31N3O MolecularWeight: 461.59734

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC3=CC=CC=C3C(=C2C#N)NC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC2(CC1)CC3=CC=CC=C3C(=C2C#N)NC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C31H31N3O/c32-21-28-29(27-17-9-8-16-26(27)20-31(28)18-10-3-11-19-31)33-30(35)34(22-24-12-4-1-5-13-24)23-25-14-6-2-7-15-25/h1-2,4-9,12-17H,3,10-11,18-20,22-23H2,(H,33,35)