[1-[2-cyanoethyl(pyridin-3-ylmethyl)carbamoyl]cyclohexyl]azanium

Systemtic Name: [1-[2-cyanoethyl(pyridin-3-ylmethyl)carbamoyl]cyclohexyl]azanium Openeye Name: [1-[2-cyanoethyl(3-pyridylmethyl)carbamoyl]cyclohexyl]ammonium CAS Name: [1-[[2-cyanoethyl(3-pyridinylmethyl)amino]-oxomethyl]cyclohexyl]ammonium IUPAC Name: [1-[2-cyanoethyl(pyridin-3-ylmethyl)carbamoyl]cyclohexyl]azanium Traditional Name: [1-[2-cyanoethyl(3-pyridylmethyl)carbamoyl]cyclohexyl]ammonium Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)N(CCC#N)CC2=CN=CC=C2)[NH3+]

Isomeric SMILES

C1CCC(CC1)(C(=O)N(CCC#N)CC2=CN=CC=C2)[NH3+]

InChI

InChI=1S/C16H22N4O/c17-9-5-11-20(13-14-6-4-10-19-12-14)15(21)16(18)7-2-1-3-8-16/h4,6,10,12H,1-3,5,7-8,11,13,18H2/p+1