[1-[5-(2-cyanopropyl)-2-methyl-cycloheptyl]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate

Systemtic Name: [1-[5-(2-cyanopropyl)-2-methyl-cycloheptyl]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate Openeye Name: [1-[5-(2-cyanopropyl)-2-methyl-cycloheptyl]-2-(trimethylammonio)ethyl] hydrogen phosphate CAS Name: [1-[5-(2-cyanopropyl)-2-methylcycloheptyl]-2-(trimethylammonio)ethyl] hydrogen phosphate IUPAC Name: [1-[5-(2-cyanopropyl)-2-methylcycloheptyl]-2-(trimethylazaniumyl)ethyl] hydrogen phosphate Traditional Name: [1-[5-(2-cyanopropyl)-2-methyl-cycloheptyl]-2-(trimethylammonio)ethyl] hydrogen phosphate Formula: C17H33N2O4P MolecularWeight: 360.428681

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CCC1C(C[N+](C)(C)C)OP(=O)(O)[O-])CC(C)C#N

Isomeric SMILES

CC1CCC(CCC1C(C[N+](C)(C)C)OP(=O)(O)[O-])CC(C)C#N

InChI

InChI=1S/C17H33N2O4P/c1-13(11-18)10-15-7-6-14(2)16(9-8-15)17(12-19(3,4)5)23-24(20,21)22/h13-17H,6-10,12H2,1-5H3,(H-,20,21,22)