2-cyclohexylethyl-[ethyl(pyridin-4-ylmethyl)carbamoyl]-(methylamino)-[(2-methylpropan-2-yl)oxycarbonyl]azanium

Systemtic Name: 2-cyclohexylethyl-[ethyl(pyridin-4-ylmethyl)carbamoyl]-(methylamino)-[(2-methylpropan-2-yl)oxycarbonyl]azanium Openeye Name: tert-butoxycarbonyl-(2-cyclohexylethyl)-[ethyl(4-pyridylmethyl)carbamoyl]-(methylamino)ammonium CAS Name: 2-cyclohexylethyl-[[ethyl(pyridin-4-ylmethyl)amino]-oxomethyl]-(methylamino)-[(2-methylpropan-2-yl)oxy-oxomethyl]ammonium IUPAC Name: 2-cyclohexylethyl-[ethyl(pyridin-4-ylmethyl)carbamoyl]-(methylamino)-[(2-methylpropan-2-yl)oxycarbonyl]azanium Traditional Name: tert-butoxycarbonyl-(2-cyclohexylethyl)-[ethyl(4-pyridylmethyl)carbamoyl]-(methylamino)ammonium Formula: C23H39N4O3+ MolecularWeight: 419.58076

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C(=O)[N+](CCC2CCCCC2)(C(=O)OC(C)(C)C)NC

Isomeric SMILES

CCN(CC1=CC=NC=C1)C(=O)[N+](CCC2CCCCC2)(C(=O)OC(C)(C)C)NC

InChI

InChI=1S/C23H39N4O3/c1-6-26(18-20-12-15-25-16-13-20)21(28)27(24-5,22(29)30-23(2,3)4)17-14-19-10-8-7-9-11-19/h12-13,15-16,19,24H,6-11,14,17-18H2,1-5H3/q+1