butyl-ethoxycarbonyl-heptanoyl-(1-methylpyrazol-3-yl)azanium

Systemtic Name: butyl-ethoxycarbonyl-heptanoyl-(1-methylpyrazol-3-yl)azanium Openeye Name: butyl-ethoxycarbonyl-heptanoyl-(1-methylpyrazol-3-yl)ammonium CAS Name: butyl-ethoxycarbonyl-(1-methyl-3-pyrazolyl)-(1-oxoheptyl)ammonium IUPAC Name: butyl-ethoxycarbonyl-heptanoyl-(1-methylpyrazol-3-yl)azanium Traditional Name: butyl-carbethoxy-enanthyl-(1-methylpyrazol-3-yl)ammonium Formula: C18H32N3O3+ MolecularWeight: 338.46498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)[N+](CCCC)(C1=NN(C=C1)C)C(=O)OCC

Isomeric SMILES

CCCCCCC(=O)[N+](CCCC)(C1=NN(C=C1)C)C(=O)OCC

InChI

InChI=1S/C18H32N3O3/c1-5-8-10-11-12-17(22)21(15-9-6-2,18(23)24-7-3)16-13-14-20(4)19-16/h13-14H,5-12,15H2,1-4H3/q+1