2,2,6-trimethyl-N1-[2-(3-methylbutyl)-4-phenethyl-phenyl]heptane-1,3,4-triamine

Systemtic Name: 2,2,6-trimethyl-N1-[2-(3-methylbutyl)-4-phenethyl-phenyl]heptane-1,3,4-triamine Openeye Name: N1-(2-isopentyl-4-phenethyl-phenyl)-2,2,6-trimethyl-heptane-1,3,4-triamine CAS Name: 2,2,6-trimethyl-N1-[2-(3-methylbutyl)-4-phenethylphenyl]heptane-1,3,4-triamine IUPAC Name: 2,2,6-trimethyl-1-N-[2-(3-methylbutyl)-4-phenethylphenyl]heptane-1,3,4-triamine Traditional Name: (3,4-diamino-2,2,6-trimethyl-heptyl)-(2-isoamyl-4-phenethyl-phenyl)amine Formula: C29H47N3 MolecularWeight: 437.70358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C=CC(=C1)CCC2=CC=CC=C2)NCC(C)(C)C(C(CC(C)C)N)N

Isomeric SMILES

CC(C)CCC1=C(C=CC(=C1)CCC2=CC=CC=C2)NCC(C)(C)C(C(CC(C)C)N)N

InChI

InChI=1S/C29H47N3/c1-21(2)12-16-25-19-24(14-13-23-10-8-7-9-11-23)15-17-27(25)32-20-29(5,6)28(31)26(30)18-22(3)4/h7-11,15,17,19,21-22,26,28,32H,12-14,16,18,20,30-31H2,1-6H3