[(3R,4R)-3-(4-propylpiperazin-4-ium-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium

Systemtic Name: [(3R,4R)-3-(4-propylpiperazin-4-ium-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium Openeye Name: [(3R,4R)-3-(4-propylpiperazin-4-ium-1-yl)chroman-4-yl]ammonium CAS Name: [(3R,4R)-3-(4-propyl-1-piperazin-4-iumyl)-3,4-dihydro-2H-1-benzopyran-4-yl]ammonium IUPAC Name: [(3R,4R)-3-(4-propylpiperazin-4-ium-1-yl)-3,4-dihydro-2H-chromen-4-yl]azanium Traditional Name: [(3R,4R)-3-(4-propylpiperazin-4-ium-1-yl)chroman-4-yl]ammonium Formula: C16H27N3O+2 MolecularWeight: 277.40508

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2COC3=CC=CC=C3C2[NH3+]

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@H]2COC3=CC=CC=C3[C@H]2[NH3+]

InChI

InChI=1S/C16H25N3O/c1-2-7-18-8-10-19(11-9-18)14-12-20-15-6-4-3-5-13(15)16(14)17/h3-6,14,16H,2,7-12,17H2,1H3/p+2/t14-,16+/m0/s1