[4-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]cyclohexyl]methanamine

Systemtic Name: [4-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]cyclohexyl]methanamine Openeye Name: [4-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]cyclohexyl]methanamine CAS Name: [4-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]cyclohexyl]methanamine IUPAC Name: [4-[[1,3-benzodioxol-5-ylmethyl-[(4-tert-butylphenyl)methyl]amino]methyl]cyclohexyl]methanamine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-(4-tert-butylbenzyl)-piperonyl-amine Formula: C27H38N2O2 MolecularWeight: 422.60282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2CCC(CC2)CN)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2CCC(CC2)CN)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H38N2O2/c1-27(2,3)24-11-8-22(9-12-24)17-29(16-21-6-4-20(15-28)5-7-21)18-23-10-13-25-26(14-23)31-19-30-25/h8-14,20-21H,4-7,15-19,28H2,1-3H3