N2,N2-bis[(4-tert-butylphenyl)methyl]-3-(4-phenylmethoxyphenyl)-N1-(2-piperidin-1-ylethyl)propane-1,2-diamine

Systemtic Name: N2,N2-bis[(4-tert-butylphenyl)methyl]-3-(4-phenylmethoxyphenyl)-N1-(2-piperidin-1-ylethyl)propane-1,2-diamine Openeye Name: 3-(4-benzyloxyphenyl)-N2,N2-bis[(4-tert-butylphenyl)methyl]-N1-[2-(1-piperidyl)ethyl]propane-1,2-diamine CAS Name: N2,N2-bis[(4-tert-butylphenyl)methyl]-3-(4-phenylmethoxyphenyl)-N1-[2-(1-piperidinyl)ethyl]propane-1,2-diamine IUPAC Name: 2-N,2-N-bis[(4-tert-butylphenyl)methyl]-3-(4-phenylmethoxyphenyl)-1-N-(2-piperidin-1-ylethyl)propane-1,2-diamine Traditional Name: [1-(4-benzoxybenzyl)-2-(2-piperidinoethylamino)ethyl]-bis(4-tert-butylbenzyl)amine Formula: C45H61N3O MolecularWeight: 659.98534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)C(C)(C)C)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)CNCCN5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)C(C)(C)C)C(CC3=CC=C(C=C3)OCC4=CC=CC=C4)CNCCN5CCCCC5

InChI

InChI=1S/C45H61N3O/c1-44(2,3)40-21-15-37(16-22-40)33-48(34-38-17-23-41(24-18-38)45(4,5)6)42(32-46-27-30-47-28-11-8-12-29-47)31-36-19-25-43(26-20-36)49-35-39-13-9-7-10-14-39/h7,9-10,13-26,42,46H,8,11-12,27-35H2,1-6H3