[(2R)-3,4-dihydro-2H-chromen-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]azanium

Systemtic Name: [(2R)-3,4-dihydro-2H-chromen-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]azanium Openeye Name: [(2R)-chroman-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]ammonium CAS Name: [(2R)-3,4-dihydro-2H-1-benzopyran-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]ammonium IUPAC Name: [(2R)-3,4-dihydro-2H-chromen-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]azanium Traditional Name: [(2R)-chroman-2-yl]methyl-methyl-[2-(1H-pyrazol-4-yl)ethyl]ammonium Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CNN=C1)CC2CCC3=CC=CC=C3O2

Isomeric SMILES

C[NH+](CCC1=CNN=C1)C[C@H]2CCC3=CC=CC=C3O2

InChI

InChI=1S/C16H21N3O/c1-19(9-8-13-10-17-18-11-13)12-15-7-6-14-4-2-3-5-16(14)20-15/h2-5,10-11,15H,6-9,12H2,1H3,(H,17,18)/p+1/t15-/m1/s1