ethyl-[[(3R)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium

Systemtic Name: ethyl-[[(3R)-3-oxidanyl-2-oxidanylidene-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium Openeye Name: ethyl-[[(3R)-3-hydroxy-1-[(4-isopropylphenyl)methyl]-2-oxo-3-piperidyl]methyl]ammonium CAS Name: ethyl-[[(3R)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]-3-piperidinyl]methyl]ammonium IUPAC Name: ethyl-[[(3R)-3-hydroxy-2-oxo-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methyl]azanium Traditional Name: ethyl-[[(3R)-3-hydroxy-1-(4-isopropylbenzyl)-2-keto-3-piperidyl]methyl]ammonium Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1(CCCN(C1=O)CC2=CC=C(C=C2)C(C)C)O

Isomeric SMILES

CC[NH2+]C[C@@]1(CCCN(C1=O)CC2=CC=C(C=C2)C(C)C)O

InChI

InChI=1S/C18H28N2O2/c1-4-19-13-18(22)10-5-11-20(17(18)21)12-15-6-8-16(9-7-15)14(2)3/h6-9,14,19,22H,4-5,10-13H2,1-3H3/p+1/t18-/m1/s1