1-(2H-chromen-3-yl)-3-(1-methylpiperazin-1-ium-1-yl)propan-1-ol

Systemtic Name: 1-(2H-chromen-3-yl)-3-(1-methylpiperazin-1-ium-1-yl)propan-1-ol Openeye Name: 1-(2H-chromen-3-yl)-3-(1-methylpiperazin-1-ium-1-yl)propan-1-ol CAS Name: 1-(2H-1-benzopyran-3-yl)-3-(1-methyl-1-piperazin-1-iumyl)-1-propanol IUPAC Name: 1-(2H-chromen-3-yl)-3-(1-methylpiperazin-1-ium-1-yl)propan-1-ol Traditional Name: 1-(2H-chromen-3-yl)-3-(1-methylpiperazin-1-ium-1-yl)propan-1-ol Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CCC(C2=CC3=CC=CC=C3OC2)O

Isomeric SMILES

C[N+]1(CCNCC1)CCC(C2=CC3=CC=CC=C3OC2)O

InChI

InChI=1S/C17H25N2O2/c1-19(10-7-18-8-11-19)9-6-16(20)15-12-14-4-2-3-5-17(14)21-13-15/h2-5,12,16,18,20H,6-11,13H2,1H3/q+1