N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1,3-benzoxazol-2-amine

Systemtic Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1,3-benzoxazol-2-amine Openeye Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1,3-benzoxazol-2-amine CAS Name: N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-1,3-benzoxazol-2-amine IUPAC Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-1,3-benzoxazol-2-amine Traditional Name: 1,3-benzoxazol-2-yl-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]amine Formula: C19H22N3O+ MolecularWeight: 308.39748

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H21N3O/c1-2-8-16(14-22-11-5-6-12-22)15(7-1)13-20-19-21-17-9-3-4-10-18(17)23-19/h1-4,7-10H,5-6,11-14H2,(H,20,21)/p+1