(4-ethoxycarbonyl-2-pyridin-2-yl-pyrazol-3-yl)methyl-methyl-[(1R)-1-(1,2-oxazol-3-yl)ethyl]azanium

Systemtic Name: (4-ethoxycarbonyl-2-pyridin-2-yl-pyrazol-3-yl)methyl-methyl-[(1R)-1-(1,2-oxazol-3-yl)ethyl]azanium Openeye Name: [4-ethoxycarbonyl-2-(2-pyridyl)pyrazol-3-yl]methyl-[(1R)-1-isoxazol-3-ylethyl]-methyl-ammonium CAS Name: [4-ethoxycarbonyl-2-(2-pyridinyl)-3-pyrazolyl]methyl-[(1R)-1-(3-isoxazolyl)ethyl]-methylammonium IUPAC Name: (4-ethoxycarbonyl-2-pyridin-2-ylpyrazol-3-yl)methyl-methyl-[(1R)-1-(1,2-oxazol-3-yl)ethyl]azanium Traditional Name: [4-carbethoxy-2-(2-pyridyl)pyrazol-3-yl]methyl-[(1R)-1-isoxazol-3-ylethyl]-methyl-ammonium Formula: C18H22N5O3+ MolecularWeight: 356.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=N2)C[NH+](C)C(C)C3=NOC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=N2)C[NH+](C)[C@H](C)C3=NOC=C3

InChI

InChI=1S/C18H21N5O3/c1-4-25-18(24)14-11-20-23(17-7-5-6-9-19-17)16(14)12-22(3)13(2)15-8-10-26-21-15/h5-11,13H,4,12H2,1-3H3/p+1/t13-/m1/s1