N3-(2-azanylethyl)-N2-octadecyl-1,4-diphenyl-N2,2-bis(phenylmethyl)butane-2,3-diamine

Systemtic Name: N3-(2-azanylethyl)-N2-octadecyl-1,4-diphenyl-N2,2-bis(phenylmethyl)butane-2,3-diamine Openeye Name: N3-(2-aminoethyl)-N2,2-dibenzyl-N2-octadecyl-1,4-diphenyl-butane-2,3-diamine CAS Name: N3-(2-aminoethyl)-N2-octadecyl-1,4-diphenyl-N2,2-bis(phenylmethyl)butane-2,3-diamine IUPAC Name: 3-N-(2-aminoethyl)-2-N,2-dibenzyl-2-N-octadecyl-1,4-diphenylbutane-2,3-diamine Traditional Name: [2-(2-aminoethylamino)-1,1-dibenzyl-3-phenyl-propyl]-benzyl-stearyl-amine Formula: C50H73N3 MolecularWeight: 716.13472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CC1=CC=CC=C1)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)C(CC4=CC=CC=C4)NCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CC1=CC=CC=C1)C(CC2=CC=CC=C2)(CC3=CC=CC=C3)C(CC4=CC=CC=C4)NCCN

InChI

InChI=1S/C50H73N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-29-40-53(44-48-36-27-20-28-37-48)50(42-46-32-23-18-24-33-46,43-47-34-25-19-26-35-47)49(52-39-38-51)41-45-30-21-17-22-31-45/h17-28,30-37,49,52H,2-16,29,38-44,51H2,1H3