[(3S,4R)-4-(2-methoxyphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]azanium

Systemtic Name: [(3S,4R)-4-(2-methoxyphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]azanium Openeye Name: [(3S,4R)-1-tert-butoxycarbonyl-4-(2-methoxyphenyl)-3-piperidyl]ammonium CAS Name: [(3S,4R)-4-(2-methoxyphenyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]ammonium IUPAC Name: [(3S,4R)-4-(2-methoxyphenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]azanium Traditional Name: [(3S,4R)-1-tert-butoxycarbonyl-4-(2-methoxyphenyl)-3-piperidyl]ammonium Formula: C17H27N2O3+ MolecularWeight: 307.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)[NH3+])C2=CC=CC=C2OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](C1)[NH3+])C2=CC=CC=C2OC

InChI

InChI=1S/C17H26N2O3/c1-17(2,3)22-16(20)19-10-9-12(14(18)11-19)13-7-5-6-8-15(13)21-4/h5-8,12,14H,9-11,18H2,1-4H3/p+1/t12-,14-/m1/s1