1-(phenylmethyl)-3-[5-[(phenylmethyl)amino]pentyl]benzimidazol-1-ium-2-amine

Systemtic Name: 1-(phenylmethyl)-3-[5-[(phenylmethyl)amino]pentyl]benzimidazol-1-ium-2-amine Openeye Name: 1-benzyl-3-[5-(benzylamino)pentyl]benzimidazol-1-ium-2-amine CAS Name: 1-(phenylmethyl)-3-[5-[(phenylmethyl)amino]pentyl]-2-benzimidazol-1-iumamine IUPAC Name: 1-benzyl-3-[5-(benzylamino)pentyl]benzimidazol-1-ium-2-amine Traditional Name: 5-(2-amino-3-benzyl-benzimidazol-3-ium-1-yl)pentyl-benzyl-amine Formula: C26H31N4+ MolecularWeight: 399.55114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCCCN2C3=CC=CC=C3[N+](=C2N)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNCCCCCN2C3=CC=CC=C3[N+](=C2N)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N4/c27-26-29(19-11-3-10-18-28-20-22-12-4-1-5-13-22)24-16-8-9-17-25(24)30(26)21-23-14-6-2-7-15-23/h1-2,4-9,12-17,27-28H,3,10-11,18-21H2/p+1