N-cyclohexyl-N-[[2-(phenylmethyl)-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl]cyclohexanamine

Systemtic Name: N-cyclohexyl-N-[[2-(phenylmethyl)-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl]cyclohexanamine Openeye Name: N-[[2-benzyl-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl]-N-cyclohexyl-cyclohexanamine CAS Name: N-cyclohexyl-N-[[2-(phenylmethyl)-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl]cyclohexanamine IUPAC Name: N-[[2-benzyl-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl]-N-cyclohexylcyclohexanamine Traditional Name: [2-benzyl-1-(trichloromethyl)-1H-isoquinolin-3-yl]methyl-dicyclohexyl-amine Formula: C30H37Cl3N2 MolecularWeight: 531.98718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC3=CC=CC=C3C(N2CC4=CC=CC=C4)C(Cl)(Cl)Cl)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)N(CC2=CC3=CC=CC=C3C(N2CC4=CC=CC=C4)C(Cl)(Cl)Cl)C5CCCCC5

InChI

InChI=1S/C30H37Cl3N2/c31-30(32,33)29-28-19-11-10-14-24(28)20-27(35(29)21-23-12-4-1-5-13-23)22-34(25-15-6-2-7-16-25)26-17-8-3-9-18-26/h1,4-5,10-14,19-20,25-26,29H,2-3,6-9,15-18,21-22H2