5-(phenylmethyl)-4-propyl-henicosan-4-amine

Systemtic Name: 5-(phenylmethyl)-4-propyl-henicosan-4-amine Openeye Name: 5-benzyl-4-propyl-henicosan-4-amine CAS Name: 5-(phenylmethyl)-4-propyl-4-heneicosanamine IUPAC Name: 5-benzyl-4-propylhenicosan-4-amine Traditional Name: (2-benzyl-1,1-dipropyl-octadecyl)amine Formula: C31H57N MolecularWeight: 443.79098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(CCC)(CCC)N

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC1=CC=CC=C1)C(CCC)(CCC)N

InChI

InChI=1S/C31H57N/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-22-25-30(28-29-23-20-19-21-24-29)31(32,26-5-2)27-6-3/h19-21,23-24,30H,4-18,22,25-28,32H2,1-3H3