N-[[1-(3-azanylpropyl)piperidin-4-yl]methyl]-1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-amine

Systemtic Name: N-[[1-(3-azanylpropyl)piperidin-4-yl]methyl]-1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-amine Openeye Name: N-[[1-(3-aminopropyl)-4-piperidyl]methyl]-1,7-bis(5-tert-butyl-2-methyl-phenyl)heptan-4-amine CAS Name: N-[[1-(3-aminopropyl)-4-piperidinyl]methyl]-1,7-bis(5-tert-butyl-2-methylphenyl)-4-heptanamine IUPAC Name: N-[[1-(3-aminopropyl)piperidin-4-yl]methyl]-1,7-bis(5-tert-butyl-2-methylphenyl)heptan-4-amine Traditional Name: [1-(3-aminopropyl)-4-piperidyl]methyl-[4-(5-tert-butyl-2-methyl-phenyl)-1-[3-(5-tert-butyl-2-methyl-phenyl)propyl]butyl]amine Formula: C38H63N3 MolecularWeight: 561.92692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)CCCC(CCCC2=C(C=CC(=C2)C(C)(C)C)C)NCC3CCN(CC3)CCCN

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)CCCC(CCCC2=C(C=CC(=C2)C(C)(C)C)C)NCC3CCN(CC3)CCCN

InChI

InChI=1S/C38H63N3/c1-29-16-18-34(37(3,4)5)26-32(29)12-9-14-36(40-28-31-20-24-41(25-21-31)23-11-22-39)15-10-13-33-27-35(38(6,7)8)19-17-30(33)2/h16-19,26-27,31,36,40H,9-15,20-25,28,39H2,1-8H3